N-(6-cyano-5-methyl-1H-indazol-3-yl)-2-piperidin-3-ylpyrazole-3-carboxamide

C18H19N7O — CID 166394379

IUPACN-(6-cyano-5-methyl-1H-indazol-3-yl)-2-piperidin-3-ylpyrazole-3-carboxamide
SMILESCc1cc2c(NC(=O)c3ccnn3C3CCCNC3)n[nH]c2cc1C#N
InChIInChI=1S/C18H19N7O/c1-11-7-14-15(8-12(11)9-19)23-24-17(14)22-18(26)16-4-6-21-25(16)13-3-2-5-20-10-13/h4,6-8,13,20H,2-3,5,10H2,1H3,(H2,22,23,24,26)
InChIKeyCOFQOMXHIGRBID-UHFFFAOYSA-N
MW349.40 g/mol
LogP2.12
Rot. Bonds3

About N-(6-cyano-5-methyl-1H-indazol-3-yl)-2-piperidin-3-ylpyrazole-3-carboxamide

N-(6-cyano-5-methyl-1H-indazol-3-yl)-2-piperidin-3-ylpyrazole-3-carboxamide (PubChem CID 166394379) has the molecular formula C18H19N7O and a molecular weight of 349.40 g/mol. Its IUPAC name is N-(6-cyano-5-methyl-1H-indazol-3-yl)-2-piperidin-3-ylpyrazole-3-carboxamide.

Molecular Properties

Compound NameN-(6-cyano-5-methyl-1H-indazol-3-yl)-2-piperidin-3-ylpyrazole-3-carboxamide
PubChem CID166394379
Molecular FormulaC18H19N7O
Molecular Weight349.40 g/mol
Exact Mass349.17
IUPAC NameN-(6-cyano-5-methyl-1H-indazol-3-yl)-2-piperidin-3-ylpyrazole-3-carboxamide
SMILESCc1cc2c(NC(=O)c3ccnn3C3CCCNC3)n[nH]c2cc1C#N
InChIInChI=1S/C18H19N7O/c1-11-7-14-15(8-12(11)9-19)23-24-17(14)22-18(26)16-4-6-21-25(16)13-3-2-5-20-10-13/h4,6-8,13,20H,2-3,5,10H2,1H3,(H2,22,23,24,26)
InChIKeyCOFQOMXHIGRBID-UHFFFAOYSA-N
XLogP2.12
TPSA111.42 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.40
LogP ≤ 52.12
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

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Related Compounds

N-(6-cyano-5-methyl-1H-indazol-3-yl)cyclopropanecarboxamide
CID 167778038
N-(6-cyano-5-methyl-1H-indazol-3-yl)-2,3,4,5-tetrahydro-1H-2-benzazepine-8-carboxamide
CID 166431465
N-(6-cyano-5-methyl-1H-indazol-3-yl)-1-(2-methylphenyl)-5-propan-2-ylpyrazole-4-carboxamide
CID 167949292
8-(aminomethyl)-N-(6-cyano-5-methyl-1H-indazol-3-yl)naphthalene-2-carboxamide;hydrochloride
CID 166431458
1-(2-chlorophenyl)-N-(6-cyano-5-methyl-1H-indazol-3-yl)-5-ethylpyrazole-4-carboxamide
CID 167928097
2-cyclopentyl-N-(5-methyl-6-oxo-1H-pyridin-3-yl)pyrazole-3-carboxamide
CID 138994299
5-amino-1-piperidin-3-ylpyrazole-4-carbonitrile;hydrochloride
CID 162313016
4,6-dimethyl-2-[(3R)-piperidin-3-yl]pyridazin-3-one
CID 166162675
3-(3,5-dimethylpyrazol-1-yl)piperidine
CID 54592912
2-cyclopentyl-N-[4-(1,2-oxazol-3-yl)phenyl]pyrazole-3-carboxamide
CID 136566757
3-(5-ethylpyrazol-1-yl)piperidine
CID 84768027
N-[4-cyano-3-(4-hydroxyphenyl)-1-[(3S)-piperidin-3-yl]pyrazol-5-yl]acetamide
CID 141408726

Frequently Asked Questions

What is the IUPAC name of N-(6-cyano-5-methyl-1H-indazol-3-yl)-2-piperidin-3-ylpyrazole-3-carboxamide?
The IUPAC name of N-(6-cyano-5-methyl-1H-indazol-3-yl)-2-piperidin-3-ylpyrazole-3-carboxamide (CID 166394379) is N-(6-cyano-5-methyl-1H-indazol-3-yl)-2-piperidin-3-ylpyrazole-3-carboxamide.
What is the SMILES notation for N-(6-cyano-5-methyl-1H-indazol-3-yl)-2-piperidin-3-ylpyrazole-3-carboxamide?
The canonical SMILES for N-(6-cyano-5-methyl-1H-indazol-3-yl)-2-piperidin-3-ylpyrazole-3-carboxamide is Cc1cc2c(NC(=O)c3ccnn3C3CCCNC3)n[nH]c2cc1C#N.
What is the InChIKey of N-(6-cyano-5-methyl-1H-indazol-3-yl)-2-piperidin-3-ylpyrazole-3-carboxamide?
The InChIKey is COFQOMXHIGRBID-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19N7O/c1-11-7-14-15(8-12(11)9-19)23-24-17(14)22-18(26)16-4-6-21-25(16)13-3-2-5-20-10-13/h4,6-8,13,20H,2-3,5,10H2,1H3,(H2,22,23,24,26).
What are the key properties of N-(6-cyano-5-methyl-1H-indazol-3-yl)-2-piperidin-3-ylpyrazole-3-carboxamide?
N-(6-cyano-5-methyl-1H-indazol-3-yl)-2-piperidin-3-ylpyrazole-3-carboxamide has a molecular weight of 349.40 g/mol, XLogP of 2.12, 3 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-cyano-5-methyl-1H-indazol-3-yl)-2-piperidin-3-ylpyrazole-3-carboxamide is sourced from PubChem (CID 166394379), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).