Cas no 89080-17-1 (3-Pyridinecarboxamide, 1,6-dihydro-1-propyl-)
89080-17-1 structure
Product Name:3-Pyridinecarboxamide, 1,6-dihydro-1-propyl-
CAS No:89080-17-1
MF:C9H14N2O
MW:166.220262050629
CID:613172
PubChem ID:19964269
Update Time:2025-04-19
3-Pyridinecarboxamide, 1,6-dihydro-1-propyl- Chemical and Physical Properties
Names and Identifiers
-
- 3-Pyridinecarboxamide, 1,6-dihydro-1-propyl-
- 1-propyl-2H-pyridine-5-carboxamide
- SCHEMBL8855845
- 89080-17-1
- DTXSID40601530
- 1-Propyl-1,6-dihydropyridine-3-carboxamide
-
- Inchi： 1S/C9H14N2O/c1-2-5-11-6-3-4-8(7-11)9(10)12/h3-4,7H,2,5-6H2,1H3,(H2,10,12)
- InChI Key： HKDPMMIEYPNEOE-UHFFFAOYSA-N
- SMILES： O=C(C1C=CCN(C=1)CCC)N
Computed Properties
- Exact Mass: 166.110613074g/mol
- Monoisotopic Mass: 166.110613074g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 12
- Rotatable Bond Count: 3
- Complexity: 231
- 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: 0.8
- Topological Polar Surface Area: 46.3?2
3-Pyridinecarboxamide, 1,6-dihydro-1-propyl- Related Literature
-
Kaiyuan Huang,Wangkang Qiu,Meilian Ou,Xiaorui Liu,Zenan Liao,Sheng Chu RSC Adv., 2020,10, 18824-18829
-
Yaqing Liu,Jiangtao Ren,Jing Li,Jiyang Liu,Erkang Wang Chem. Commun., 2012,48, 802-804
-
Bo Cao,Yin Wei Chem. Commun., 2018,54, 2870-2873
-
Yang Xu,Min Wang,Donghui Wei,Rongqiang Tian,Zheng Duan,Fran?ois Mathey Dalton Trans., 2019,48, 5523-5526
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