N-(4-methyl-1H-indazol-7-yl)pyrrolidine-2-carboxamide;hydrochloride

C13H17ClN4O — CID 119307375

IUPACN-(4-methyl-1H-indazol-7-yl)pyrrolidine-2-carboxamide;hydrochloride
SMILESCc1ccc(NC(=O)C2CCCN2)c2[nH]ncc12.Cl
InChIInChI=1S/C13H16N4O.ClH/c1-8-4-5-10(12-9(8)7-15-17-12)16-13(18)11-3-2-6-14-11;/h4-5,7,11,14H,2-3,6H2,1H3,(H,15,17)(H,16,18);1H
InChIKeyGOJCOVNKCGYPQM-UHFFFAOYSA-N
MW280.76 g/mol
LogP1.98
Rot. Bonds2

About N-(4-methyl-1H-indazol-7-yl)pyrrolidine-2-carboxamide;hydrochloride

N-(4-methyl-1H-indazol-7-yl)pyrrolidine-2-carboxamide;hydrochloride (PubChem CID 119307375) has the molecular formula C13H17ClN4O and a molecular weight of 280.76 g/mol. Its IUPAC name is N-(4-methyl-1H-indazol-7-yl)pyrrolidine-2-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-(4-methyl-1H-indazol-7-yl)pyrrolidine-2-carboxamide;hydrochloride
PubChem CID119307375
Molecular FormulaC13H17ClN4O
Molecular Weight280.76 g/mol
Exact Mass280.11
IUPAC NameN-(4-methyl-1H-indazol-7-yl)pyrrolidine-2-carboxamide;hydrochloride
SMILESCc1ccc(NC(=O)C2CCCN2)c2[nH]ncc12.Cl
InChIInChI=1S/C13H16N4O.ClH/c1-8-4-5-10(12-9(8)7-15-17-12)16-13(18)11-3-2-6-14-11;/h4-5,7,11,14H,2-3,6H2,1H3,(H,15,17)(H,16,18);1H
InChIKeyGOJCOVNKCGYPQM-UHFFFAOYSA-N
XLogP1.98
TPSA69.81 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.76
LogP ≤ 51.98
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

(2R)-N-(1H-indazol-7-yl)pyrrolidine-2-carboxamide
CID 113263883
(2R)-N-(3-methoxy-2,4-dimethylphenyl)pyrrolidine-2-carboxamide
CID 113263992
trans-(1S,2S)-N-(4-methyl-1H-indazol-7-yl)-2-(trifluoromethyl)cyclohexane-1-carboxamide
CID 95259732
(2S)-N-(3-hydroxy-2,4-dimethylphenyl)pyrrolidine-2-carboxamide
CID 61179515
N-(3-hydroxy-2,4-dimethylphenyl)pyrrolidine-2-carboxamide
CID 43710389
N-(5-methyl-1H-pyrazol-4-yl)piperidine-2-carboxamide
CID 110837895
(2S)-N-(5-fluoro-2-methylphenyl)piperidine-2-carboxamide;hydrochloride
CID 119674019
2-cyclopropyl-N-(4-methyl-1H-indazol-7-yl)acetamide
CID 166191921
N-(2,4,5-trimethylphenyl)pyrrolidine-2-carboxamide
CID 82495828
(2S)-N-(4-methyl-3-pyridinyl)pyrrolidine-2-carboxamide
CID 63327750
(2S)-N-(2,3-dimethylphenyl)pyrrolidine-2-carboxamide;hydrochloride
CID 119261902
N-(5-chloro-2-methylphenyl)piperidine-2-carboxamide;hydrochloride
CID 119264186

Frequently Asked Questions

What is the IUPAC name of N-(4-methyl-1H-indazol-7-yl)pyrrolidine-2-carboxamide;hydrochloride?
The IUPAC name of N-(4-methyl-1H-indazol-7-yl)pyrrolidine-2-carboxamide;hydrochloride (CID 119307375) is N-(4-methyl-1H-indazol-7-yl)pyrrolidine-2-carboxamide;hydrochloride.
What is the SMILES notation for N-(4-methyl-1H-indazol-7-yl)pyrrolidine-2-carboxamide;hydrochloride?
The canonical SMILES for N-(4-methyl-1H-indazol-7-yl)pyrrolidine-2-carboxamide;hydrochloride is Cc1ccc(NC(=O)C2CCCN2)c2[nH]ncc12.Cl.
What is the InChIKey of N-(4-methyl-1H-indazol-7-yl)pyrrolidine-2-carboxamide;hydrochloride?
The InChIKey is GOJCOVNKCGYPQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N4O.ClH/c1-8-4-5-10(12-9(8)7-15-17-12)16-13(18)11-3-2-6-14-11;/h4-5,7,11,14H,2-3,6H2,1H3,(H,15,17)(H,16,18);1H.
What are the key properties of N-(4-methyl-1H-indazol-7-yl)pyrrolidine-2-carboxamide;hydrochloride?
N-(4-methyl-1H-indazol-7-yl)pyrrolidine-2-carboxamide;hydrochloride has a molecular weight of 280.76 g/mol, XLogP of 1.98, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methyl-1H-indazol-7-yl)pyrrolidine-2-carboxamide;hydrochloride is sourced from PubChem (CID 119307375), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).