N-(3-acetamidophenyl)-1H-indazole-3-carboxamide

C16H14N4O2 — CID 9114494

IUPACN-(3-acetamidophenyl)-1H-indazole-3-carboxamide
SMILESCC(=O)Nc1cccc(NC(=O)c2n[nH]c3ccccc23)c1
InChIInChI=1S/C16H14N4O2/c1-10(21)17-11-5-4-6-12(9-11)18-16(22)15-13-7-2-3-8-14(13)19-20-15/h2-9H,1H3,(H,17,21)(H,18,22)(H,19,20)
InChIKeyCOAOKXZYECPKQN-UHFFFAOYSA-N
MW294.31 g/mol
LogP2.77
Rot. Bonds3

About N-(3-acetamidophenyl)-1H-indazole-3-carboxamide

N-(3-acetamidophenyl)-1H-indazole-3-carboxamide (PubChem CID 9114494) has the molecular formula C16H14N4O2 and a molecular weight of 294.31 g/mol. Its IUPAC name is N-(3-acetamidophenyl)-1H-indazole-3-carboxamide.

Molecular Properties

Compound NameN-(3-acetamidophenyl)-1H-indazole-3-carboxamide
PubChem CID9114494
Molecular FormulaC16H14N4O2
Molecular Weight294.31 g/mol
Exact Mass294.11
IUPAC NameN-(3-acetamidophenyl)-1H-indazole-3-carboxamide
SMILESCC(=O)Nc1cccc(NC(=O)c2n[nH]c3ccccc23)c1
InChIInChI=1S/C16H14N4O2/c1-10(21)17-11-5-4-6-12(9-11)18-16(22)15-13-7-2-3-8-14(13)19-20-15/h2-9H,1H3,(H,17,21)(H,18,22)(H,19,20)
InChIKeyCOAOKXZYECPKQN-UHFFFAOYSA-N
XLogP2.77
TPSA86.88 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.31
LogP ≤ 52.77
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-[3-(2,2-dimethylpropanoylamino)phenyl]-1H-indazole-3-carboxamide
CID 30694461
N-(3-cyanophenyl)-1H-indazole-3-carboxamide
CID 40711329
2-[3-(1H-indazole-3-carbonylamino)phenyl]acetic acid
CID 170858284
N-(3-acetamidophenyl)-2-oxo-1H-quinazoline-4-carboxamide
CID 110702604
N-(4-bromo-3-methylphenyl)-1H-indazole-3-carboxamide
CID 9069923
N-[(4-acetamidophenyl)methyl]-1H-indazole-3-carboxamide
CID 18154228
N-(2-methylpyrimidin-5-yl)-1H-indazole-3-carboxamide
CID 154796255
N-(4-propan-2-ylphenyl)-1H-indazole-3-carboxamide
CID 42477807
N-(3-methoxyphenyl)-4-oxo-1H-cinnoline-3-carboxamide
CID 21241368
2-fluoro-5-(1H-indazole-3-carbonylamino)benzoic acid
CID 170858296
N-quinolin-7-yl-1H-indazole-3-carboxamide
CID 28734040
N-[3-(azepan-1-ylsulfonyl)phenyl]-1H-indazole-3-carboxamide
CID 17417619

Frequently Asked Questions

What is the IUPAC name of N-(3-acetamidophenyl)-1H-indazole-3-carboxamide?
The IUPAC name of N-(3-acetamidophenyl)-1H-indazole-3-carboxamide (CID 9114494) is N-(3-acetamidophenyl)-1H-indazole-3-carboxamide.
What is the SMILES notation for N-(3-acetamidophenyl)-1H-indazole-3-carboxamide?
The canonical SMILES for N-(3-acetamidophenyl)-1H-indazole-3-carboxamide is CC(=O)Nc1cccc(NC(=O)c2n[nH]c3ccccc23)c1.
What is the InChIKey of N-(3-acetamidophenyl)-1H-indazole-3-carboxamide?
The InChIKey is COAOKXZYECPKQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14N4O2/c1-10(21)17-11-5-4-6-12(9-11)18-16(22)15-13-7-2-3-8-14(13)19-20-15/h2-9H,1H3,(H,17,21)(H,18,22)(H,19,20).
What are the key properties of N-(3-acetamidophenyl)-1H-indazole-3-carboxamide?
N-(3-acetamidophenyl)-1H-indazole-3-carboxamide has a molecular weight of 294.31 g/mol, XLogP of 2.77, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-acetamidophenyl)-1H-indazole-3-carboxamide is sourced from PubChem (CID 9114494), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).