Cas no 89009-75-6 (1H-1,4-Diazepine-1-propanamide, hexahydro-N-(1-methylethyl)-)
89009-75-6 structure
Product Name:1H-1,4-Diazepine-1-propanamide, hexahydro-N-(1-methylethyl)-
CAS No:89009-75-6
MF:C11H23N3O
MW:213.31982254982
CID:616137
PubChem ID:13270106
Update Time:2025-04-19
1H-1,4-Diazepine-1-propanamide, hexahydro-N-(1-methylethyl)- Chemical and Physical Properties
Names and Identifiers
-
- 1H-1,4-Diazepine-1-propanamide, hexahydro-N-(1-methylethyl)-
- 3-(1,4-diazepan-1-yl)-N-propan-2-ylpropanamide
- 89009-75-6
- DTXSID50533515
- 3-(1,4-Diazepan-1-yl)-N-(propan-2-yl)propanamide
- AKOS005261977
-
- Inchi： 1S/C11H23N3O/c1-10(2)13-11(15)4-8-14-7-3-5-12-6-9-14/h10,12H,3-9H2,1-2H3,(H,13,15)
- InChI Key： DDSLGEDAUXKYCL-UHFFFAOYSA-N
- SMILES： O=C(CCN1CCNCCC1)NC(C)C
Computed Properties
- Exact Mass: 213.184112366g/mol
- Monoisotopic Mass: 213.184112366g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 15
- Rotatable Bond Count: 4
- Complexity: 194
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 0
- Topological Polar Surface Area: 44.4?2
1H-1,4-Diazepine-1-propanamide, hexahydro-N-(1-methylethyl)- Related Literature
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Bidyut Kumar Kundu,Rinky Singh,Ritudhwaj Tiwari,Debasis Nayak New J. Chem., 2019,43, 4867-4877
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J. M. Granadino-Roldán,M. Fernández-Gómez,A. Navarro,T. Pe?a Ruiz,U. A. Jayasooriya Phys. Chem. Chem. Phys., 2004,6, 1133-1143
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3. An autonomous self-optimizing flow machine for the synthesis of pyridine–oxazoline (PyOX) ligands?Eric Wimmer,Daniel Cortés-Borda,Solène Brochard,Elvina Barré,Charlotte Truchet,Fran?ois-Xavier Felpin React. Chem. Eng., 2019,4, 1608-1615
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Kaiyuan Huang,Wangkang Qiu,Meilian Ou,Xiaorui Liu,Zenan Liao,Sheng Chu RSC Adv., 2020,10, 18824-18829
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Eunhak Lim,Jiyoung Heo,Seong Keun Kim Nanoscale, 2019,11, 11369-11378
89009-75-6 (1H-1,4-Diazepine-1-propanamide, hexahydro-N-(1-methylethyl)-) Related Products
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