1-cyclopentyl-N-[(4,6-dimethyl-2-oxo-3H-pyridin-3-yl)methyl]indazole-4-carboxamide

C21H24N4O2 — CID 77426246

IUPAC1-cyclopentyl-N-[(4,6-dimethyl-2-oxo-3H-pyridin-3-yl)methyl]indazole-4-carboxamide
SMILESCC1=CC(C)=NC(=O)C1CNC(=O)c1cccc2c1cnn2C1CCCC1
InChIInChI=1S/C21H24N4O2/c1-13-10-14(2)24-21(27)17(13)11-22-20(26)16-8-5-9-19-18(16)12-23-25(19)15-6-3-4-7-15/h5,8-10,12,15,17H,3-4,6-7,11H2,1-2H3,(H,22,26)
InChIKeyGAPSJQQVQFFMEX-UHFFFAOYSA-N
MW364.45 g/mol
LogP3.44
Rot. Bonds4

About 1-cyclopentyl-N-[(4,6-dimethyl-2-oxo-3H-pyridin-3-yl)methyl]indazole-4-carboxamide

1-cyclopentyl-N-[(4,6-dimethyl-2-oxo-3H-pyridin-3-yl)methyl]indazole-4-carboxamide (PubChem CID 77426246) has the molecular formula C21H24N4O2 and a molecular weight of 364.45 g/mol. Its IUPAC name is 1-cyclopentyl-N-[(4,6-dimethyl-2-oxo-3H-pyridin-3-yl)methyl]indazole-4-carboxamide.

Molecular Properties

Compound Name1-cyclopentyl-N-[(4,6-dimethyl-2-oxo-3H-pyridin-3-yl)methyl]indazole-4-carboxamide
PubChem CID77426246
Molecular FormulaC21H24N4O2
Molecular Weight364.45 g/mol
Exact Mass364.19
IUPAC Name1-cyclopentyl-N-[(4,6-dimethyl-2-oxo-3H-pyridin-3-yl)methyl]indazole-4-carboxamide
SMILESCC1=CC(C)=NC(=O)C1CNC(=O)c1cccc2c1cnn2C1CCCC1
InChIInChI=1S/C21H24N4O2/c1-13-10-14(2)24-21(27)17(13)11-22-20(26)16-8-5-9-19-18(16)12-23-25(19)15-6-3-4-7-15/h5,8-10,12,15,17H,3-4,6-7,11H2,1-2H3,(H,22,26)
InChIKeyGAPSJQQVQFFMEX-UHFFFAOYSA-N
XLogP3.44
TPSA76.35 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.45
LogP ≤ 53.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-cyclopentyl-N-[(4,6-dimethyl-2-oxo-3H-pyridin-3-yl)methyl]indazole-4-carboxamide?
The IUPAC name of 1-cyclopentyl-N-[(4,6-dimethyl-2-oxo-3H-pyridin-3-yl)methyl]indazole-4-carboxamide (CID 77426246) is 1-cyclopentyl-N-[(4,6-dimethyl-2-oxo-3H-pyridin-3-yl)methyl]indazole-4-carboxamide.
What is the SMILES notation for 1-cyclopentyl-N-[(4,6-dimethyl-2-oxo-3H-pyridin-3-yl)methyl]indazole-4-carboxamide?
The canonical SMILES for 1-cyclopentyl-N-[(4,6-dimethyl-2-oxo-3H-pyridin-3-yl)methyl]indazole-4-carboxamide is CC1=CC(C)=NC(=O)C1CNC(=O)c1cccc2c1cnn2C1CCCC1.
What is the InChIKey of 1-cyclopentyl-N-[(4,6-dimethyl-2-oxo-3H-pyridin-3-yl)methyl]indazole-4-carboxamide?
The InChIKey is GAPSJQQVQFFMEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H24N4O2/c1-13-10-14(2)24-21(27)17(13)11-22-20(26)16-8-5-9-19-18(16)12-23-25(19)15-6-3-4-7-15/h5,8-10,12,15,17H,3-4,6-7,11H2,1-2H3,(H,22,26).
What are the key properties of 1-cyclopentyl-N-[(4,6-dimethyl-2-oxo-3H-pyridin-3-yl)methyl]indazole-4-carboxamide?
1-cyclopentyl-N-[(4,6-dimethyl-2-oxo-3H-pyridin-3-yl)methyl]indazole-4-carboxamide has a molecular weight of 364.45 g/mol, XLogP of 3.44, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentyl-N-[(4,6-dimethyl-2-oxo-3H-pyridin-3-yl)methyl]indazole-4-carboxamide is sourced from PubChem (CID 77426246), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).