N-[(2-methylcyclopentyl)methyl]-1H-indazole-6-carboxamide

C15H19N3O — CID 107420262

IUPACN-[(2-methylcyclopentyl)methyl]-1H-indazole-6-carboxamide
SMILESCC1CCCC1CNC(=O)c1ccc2cn[nH]c2c1
InChIInChI=1S/C15H19N3O/c1-10-3-2-4-12(10)8-16-15(19)11-5-6-13-9-17-18-14(13)7-11/h5-7,9-10,12H,2-4,8H2,1H3,(H,16,19)(H,17,18)
InChIKeySZKDSXMCBYBSAU-UHFFFAOYSA-N
MW257.34 g/mol
LogP2.73
Rot. Bonds3

About N-[(2-methylcyclopentyl)methyl]-1H-indazole-6-carboxamide

N-[(2-methylcyclopentyl)methyl]-1H-indazole-6-carboxamide (PubChem CID 107420262) has the molecular formula C15H19N3O and a molecular weight of 257.34 g/mol. Its IUPAC name is N-[(2-methylcyclopentyl)methyl]-1H-indazole-6-carboxamide.

Molecular Properties

Compound NameN-[(2-methylcyclopentyl)methyl]-1H-indazole-6-carboxamide
PubChem CID107420262
Molecular FormulaC15H19N3O
Molecular Weight257.34 g/mol
Exact Mass257.15
IUPAC NameN-[(2-methylcyclopentyl)methyl]-1H-indazole-6-carboxamide
SMILESCC1CCCC1CNC(=O)c1ccc2cn[nH]c2c1
InChIInChI=1S/C15H19N3O/c1-10-3-2-4-12(10)8-16-15(19)11-5-6-13-9-17-18-14(13)7-11/h5-7,9-10,12H,2-4,8H2,1H3,(H,16,19)(H,17,18)
InChIKeySZKDSXMCBYBSAU-UHFFFAOYSA-N
XLogP2.73
TPSA57.78 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.34
LogP ≤ 52.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-[(2-methylcyclopentyl)methyl]-1H-indazole-6-carboxamide?
The IUPAC name of N-[(2-methylcyclopentyl)methyl]-1H-indazole-6-carboxamide (CID 107420262) is N-[(2-methylcyclopentyl)methyl]-1H-indazole-6-carboxamide.
What is the SMILES notation for N-[(2-methylcyclopentyl)methyl]-1H-indazole-6-carboxamide?
The canonical SMILES for N-[(2-methylcyclopentyl)methyl]-1H-indazole-6-carboxamide is CC1CCCC1CNC(=O)c1ccc2cn[nH]c2c1.
What is the InChIKey of N-[(2-methylcyclopentyl)methyl]-1H-indazole-6-carboxamide?
The InChIKey is SZKDSXMCBYBSAU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O/c1-10-3-2-4-12(10)8-16-15(19)11-5-6-13-9-17-18-14(13)7-11/h5-7,9-10,12H,2-4,8H2,1H3,(H,16,19)(H,17,18).
What are the key properties of N-[(2-methylcyclopentyl)methyl]-1H-indazole-6-carboxamide?
N-[(2-methylcyclopentyl)methyl]-1H-indazole-6-carboxamide has a molecular weight of 257.34 g/mol, XLogP of 2.73, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-methylcyclopentyl)methyl]-1H-indazole-6-carboxamide is sourced from PubChem (CID 107420262), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).