2-(1H-indazol-7-ylcarbamoyl)cyclopentane-1-carboxylic acid

C14H15N3O3 — CID 103978246

IUPAC2-(1H-indazol-7-ylcarbamoyl)cyclopentane-1-carboxylic acid
SMILESO=C(O)C1CCCC1C(=O)Nc1cccc2cn[nH]c12
InChIInChI=1S/C14H15N3O3/c18-13(9-4-2-5-10(9)14(19)20)16-11-6-1-3-8-7-15-17-12(8)11/h1,3,6-7,9-10H,2,4-5H2,(H,15,17)(H,16,18)(H,19,20)
InChIKeyWYSKWLYGLOJRDB-UHFFFAOYSA-N
MW273.29 g/mol
LogP2.00
Rot. Bonds3

About 2-(1H-indazol-7-ylcarbamoyl)cyclopentane-1-carboxylic acid

2-(1H-indazol-7-ylcarbamoyl)cyclopentane-1-carboxylic acid (PubChem CID 103978246) has the molecular formula C14H15N3O3 and a molecular weight of 273.29 g/mol. Its IUPAC name is 2-(1H-indazol-7-ylcarbamoyl)cyclopentane-1-carboxylic acid.

Molecular Properties

Compound Name2-(1H-indazol-7-ylcarbamoyl)cyclopentane-1-carboxylic acid
PubChem CID103978246
Molecular FormulaC14H15N3O3
Molecular Weight273.29 g/mol
Exact Mass273.11
IUPAC Name2-(1H-indazol-7-ylcarbamoyl)cyclopentane-1-carboxylic acid
SMILESO=C(O)C1CCCC1C(=O)Nc1cccc2cn[nH]c12
InChIInChI=1S/C14H15N3O3/c18-13(9-4-2-5-10(9)14(19)20)16-11-6-1-3-8-7-15-17-12(8)11/h1,3,6-7,9-10H,2,4-5H2,(H,15,17)(H,16,18)(H,19,20)
InChIKeyWYSKWLYGLOJRDB-UHFFFAOYSA-N
XLogP2.00
TPSA95.08 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.29
LogP ≤ 52.00
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

2-(1H-indazol-7-ylcarbamoyl)cyclopropane-1-carboxylic acid
CID 54868364
cis-(1S,2R)-N-(1H-indazol-7-yl)-2-(pyrrolidine-1-carbonyl)cyclohexane-1-carboxamide
CID 95979860
trans-(1S,2S)-N-(1H-indazol-7-yl)-2-methylcyclopropane-1-carboxamide
CID 34148096
(2R)-N-(1H-indazol-7-yl)pyrrolidine-2-carboxamide
CID 113263883
N-(1H-indazol-7-yl)-1,2,3,3a,4,5,6,6a-octahydrocyclopenta[c]pyrrole-3-carboxamide
CID 102891325
trans-(1R,2R)-2-(naphthalen-1-ylcarbamoyl)cyclohexane-1-carboxylic acid
CID 823443
N-(1H-indazol-7-yl)-5-oxopyrrolidine-3-carboxamide
CID 78982095
N-(1H-indazol-7-yl)-4-[(2-methylcyclopropanecarbonyl)amino]benzamide
CID 46430877
(3R,4S)-N-(1H-indazol-7-yl)-4-(1-methylpyrazol-4-yl)pyrrolidine-3-carboxamide
CID 120921147
2-[(2,3-dichlorophenyl)carbamoyl]cyclopentane-1-carboxylic acid
CID 103977750
cis-(1R,2S)-N-[3-(1H-indazol-7-ylamino)-3-oxopropyl]-2-methylcyclopropane-1-carboxamide
CID 38015559
trans-(1R,2R)-N-[3-(1H-indazol-7-ylamino)-3-oxopropyl]-2-methylcyclopropane-1-carboxamide
CID 38015553

Frequently Asked Questions

What is the IUPAC name of 2-(1H-indazol-7-ylcarbamoyl)cyclopentane-1-carboxylic acid?
The IUPAC name of 2-(1H-indazol-7-ylcarbamoyl)cyclopentane-1-carboxylic acid (CID 103978246) is 2-(1H-indazol-7-ylcarbamoyl)cyclopentane-1-carboxylic acid.
What is the SMILES notation for 2-(1H-indazol-7-ylcarbamoyl)cyclopentane-1-carboxylic acid?
The canonical SMILES for 2-(1H-indazol-7-ylcarbamoyl)cyclopentane-1-carboxylic acid is O=C(O)C1CCCC1C(=O)Nc1cccc2cn[nH]c12.
What is the InChIKey of 2-(1H-indazol-7-ylcarbamoyl)cyclopentane-1-carboxylic acid?
The InChIKey is WYSKWLYGLOJRDB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N3O3/c18-13(9-4-2-5-10(9)14(19)20)16-11-6-1-3-8-7-15-17-12(8)11/h1,3,6-7,9-10H,2,4-5H2,(H,15,17)(H,16,18)(H,19,20).
What are the key properties of 2-(1H-indazol-7-ylcarbamoyl)cyclopentane-1-carboxylic acid?
2-(1H-indazol-7-ylcarbamoyl)cyclopentane-1-carboxylic acid has a molecular weight of 273.29 g/mol, XLogP of 2.00, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1H-indazol-7-ylcarbamoyl)cyclopentane-1-carboxylic acid is sourced from PubChem (CID 103978246), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).