Cas no 720669-98-7 (N-Isopropyl-1-methyl-1H-indazole-3-carboxamide)
720669-98-7 structure
Product Name:N-Isopropyl-1-methyl-1H-indazole-3-carboxamide
CAS No:720669-98-7
MF:C12H15N3O
MW:217.267002344131
CID:1088467
PubChem ID:4345591
Update Time:2025-04-20
N-Isopropyl-1-methyl-1H-indazole-3-carboxamide Chemical and Physical Properties
Names and Identifiers
-
- N-Isopropyl-1-methyl-1H-indazole-3-carboxamide
- 1-methyl-N-propan-2-ylindazole-3-carboxamide
- 1-methyl-N-(propan-2-yl)-1H-indazole-3-carboxamide
- MLS000700094
- SMR000224477
- AA-504/36954103
- CHEMBL1322347
- 720669-98-7
- HMS2512J20
-
- Inchi： 1S/C12H15N3O/c1-8(2)13-12(16)11-9-6-4-5-7-10(9)15(3)14-11/h4-8H,1-3H3,(H,13,16)
- InChI Key： KQXPXBSGDFMCNL-UHFFFAOYSA-N
- SMILES： O=C(C1C2C=CC=CC=2N(C)N=1)NC(C)C
Computed Properties
- Exact Mass: 217.121512110g/mol
- Monoisotopic Mass: 217.121512110g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 16
- Rotatable Bond Count: 2
- Complexity: 267
- 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: 2
- Topological Polar Surface Area: 46.9?2
N-Isopropyl-1-methyl-1H-indazole-3-carboxamide Related Literature
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Jingquan Liu,Huiyun Liu,Zhongfan Jia,Volga Bulmus,Thomas P. Davis Chem. Commun., 2008, 6582-6584
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Inês S. Albuquerque,Hélia F. Jeremias,Miguel Chaves-Ferreira,Dijana Matak-Vinkovic,Omar Boutureira,Carlos C. Rom?o Chem. Commun., 2015,51, 3993-3996
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Jialiang Yuan,Ran Dong,Yuan Li,Yang Liu,Zhuo Zheng,Yuxia Liu,Yan Sun,Benhe Zhong,Zhenguo Wu,Xiaodong Guo Chem. Commun., 2021,57, 13004-13007
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Luke L. Lairson,Warren W. Wakarchuk Chem. Commun., 2007, 365-367
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Chengbin Yang,Hing Lun Tsang,Pui Man Lau,Ken-Tye Yong,Ho Pui Ho,Siu Kai Kong Analyst, 2017,142, 3579-3587
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