N-[(1-methylcyclobutyl)methyl]-1H-indazole-3-carboxamide

C14H17N3O — CID 103737418

IUPACN-[(1-methylcyclobutyl)methyl]-1H-indazole-3-carboxamide
SMILESCC1(CNC(=O)c2n[nH]c3ccccc23)CCC1
InChIInChI=1S/C14H17N3O/c1-14(7-4-8-14)9-15-13(18)12-10-5-2-3-6-11(10)16-17-12/h2-3,5-6H,4,7-9H2,1H3,(H,15,18)(H,16,17)
InChIKeyZODBJBHYMWZLLH-UHFFFAOYSA-N
MW243.31 g/mol
LogP2.48
Rot. Bonds3

About N-[(1-methylcyclobutyl)methyl]-1H-indazole-3-carboxamide

N-[(1-methylcyclobutyl)methyl]-1H-indazole-3-carboxamide (PubChem CID 103737418) has the molecular formula C14H17N3O and a molecular weight of 243.31 g/mol. Its IUPAC name is N-[(1-methylcyclobutyl)methyl]-1H-indazole-3-carboxamide.

Molecular Properties

Compound NameN-[(1-methylcyclobutyl)methyl]-1H-indazole-3-carboxamide
PubChem CID103737418
Molecular FormulaC14H17N3O
Molecular Weight243.31 g/mol
Exact Mass243.14
IUPAC NameN-[(1-methylcyclobutyl)methyl]-1H-indazole-3-carboxamide
SMILESCC1(CNC(=O)c2n[nH]c3ccccc23)CCC1
InChIInChI=1S/C14H17N3O/c1-14(7-4-8-14)9-15-13(18)12-10-5-2-3-6-11(10)16-17-12/h2-3,5-6H,4,7-9H2,1H3,(H,15,18)(H,16,17)
InChIKeyZODBJBHYMWZLLH-UHFFFAOYSA-N
XLogP2.48
TPSA57.78 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.31
LogP ≤ 52.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(1-phenylcyclobutyl)methyl]-1H-indazole-3-carboxamide
CID 17488509
1-[(1H-indazole-3-carbonylamino)methyl]cyclopropane-1-carboxylic acid
CID 115449941
N-[[1-(2-methoxyphenyl)cyclopentyl]methyl]-1H-indazole-3-carboxamide
CID 52735058
N-[[1-(2-hydroxyethyl)cyclopropyl]methyl]-1H-indazole-3-carboxamide
CID 114751357
N-[[1-(2-methoxyethyl)cyclopropyl]methyl]-1H-indazole-3-carboxamide
CID 103800055
N-(1-methylcyclohexyl)-1H-indazole-3-carboxamide
CID 61229539
N-[1-[(dimethylamino)methyl]cyclobutyl]-1H-indazole-3-carboxamide
CID 154735264
N-(2-methylpropyl)-1H-indazole-3-carboxamide
CID 42477800
N-(2,2-dimethylcyclopentyl)-1H-indazole-3-carboxamide
CID 79833072
N-(2-cyclopentylethyl)-1H-indazole-3-carboxamide
CID 60735601
N-[3-(aminomethyl)pentan-3-yl]-1H-indazole-3-carboxamide
CID 63889553
N-[[(4aS,7aR)-1-ethyl-2-oxo-3,4,5,6,7,7a-hexahydrocyclopenta[b]pyridin-4a-yl]methyl]-1H-indazole-3-carboxamide
CID 87053455

Frequently Asked Questions

What is the IUPAC name of N-[(1-methylcyclobutyl)methyl]-1H-indazole-3-carboxamide?
The IUPAC name of N-[(1-methylcyclobutyl)methyl]-1H-indazole-3-carboxamide (CID 103737418) is N-[(1-methylcyclobutyl)methyl]-1H-indazole-3-carboxamide.
What is the SMILES notation for N-[(1-methylcyclobutyl)methyl]-1H-indazole-3-carboxamide?
The canonical SMILES for N-[(1-methylcyclobutyl)methyl]-1H-indazole-3-carboxamide is CC1(CNC(=O)c2n[nH]c3ccccc23)CCC1.
What is the InChIKey of N-[(1-methylcyclobutyl)methyl]-1H-indazole-3-carboxamide?
The InChIKey is ZODBJBHYMWZLLH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3O/c1-14(7-4-8-14)9-15-13(18)12-10-5-2-3-6-11(10)16-17-12/h2-3,5-6H,4,7-9H2,1H3,(H,15,18)(H,16,17).
What are the key properties of N-[(1-methylcyclobutyl)methyl]-1H-indazole-3-carboxamide?
N-[(1-methylcyclobutyl)methyl]-1H-indazole-3-carboxamide has a molecular weight of 243.31 g/mol, XLogP of 2.48, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-methylcyclobutyl)methyl]-1H-indazole-3-carboxamide is sourced from PubChem (CID 103737418), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).