3-(1H-indazole-5-carbonylamino)cyclopentane-1-carboxylic acid

C14H15N3O3 — CID 66030707

IUPAC3-(1H-indazole-5-carbonylamino)cyclopentane-1-carboxylic acid
SMILESO=C(NC1CCC(C(=O)O)C1)c1ccc2[nH]ncc2c1
InChIInChI=1S/C14H15N3O3/c18-13(16-11-3-1-9(6-11)14(19)20)8-2-4-12-10(5-8)7-15-17-12/h2,4-5,7,9,11H,1,3,6H2,(H,15,17)(H,16,18)(H,19,20)
InChIKeyNWIJEPGXOOKGAQ-UHFFFAOYSA-N
MW273.29 g/mol
LogP1.55
Rot. Bonds3

About 3-(1H-indazole-5-carbonylamino)cyclopentane-1-carboxylic acid

3-(1H-indazole-5-carbonylamino)cyclopentane-1-carboxylic acid (PubChem CID 66030707) has the molecular formula C14H15N3O3 and a molecular weight of 273.29 g/mol. Its IUPAC name is 3-(1H-indazole-5-carbonylamino)cyclopentane-1-carboxylic acid.

Molecular Properties

Compound Name3-(1H-indazole-5-carbonylamino)cyclopentane-1-carboxylic acid
PubChem CID66030707
Molecular FormulaC14H15N3O3
Molecular Weight273.29 g/mol
Exact Mass273.11
IUPAC Name3-(1H-indazole-5-carbonylamino)cyclopentane-1-carboxylic acid
SMILESO=C(NC1CCC(C(=O)O)C1)c1ccc2[nH]ncc2c1
InChIInChI=1S/C14H15N3O3/c18-13(16-11-3-1-9(6-11)14(19)20)8-2-4-12-10(5-8)7-15-17-12/h2,4-5,7,9,11H,1,3,6H2,(H,15,17)(H,16,18)(H,19,20)
InChIKeyNWIJEPGXOOKGAQ-UHFFFAOYSA-N
XLogP1.55
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 ≤ 51.55
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

4-(1H-indazole-5-carbonylamino)cyclohexane-1-carboxylic acid
CID 60810348
N-(3-methylcyclopentyl)-1H-indazole-5-carboxamide
CID 114550169
3-(1H-indazole-6-carbonylamino)cyclohexane-1-carboxylic acid
CID 63043468
N-[4-(propan-2-ylamino)cyclohexyl]-1H-indazole-5-carboxamide
CID 18447571
N-[(1R,3R)-3-(dimethylamino)cyclohexyl]-1H-indazole-5-carboxamide
CID 97056408
N-[4-(oxan-4-ylamino)cyclohexyl]-1H-indazole-5-carboxamide
CID 22933507
N-(1-methylazepan-3-yl)-1H-indazole-5-carboxamide
CID 22933430
cis-(1R,3S)-3-[(5-methyl-1H-indazole-7-carbonyl)amino]cyclopentane-1-carboxylic acid
CID 120678335
N-methyl-1H-indazole-5-carboxamide
CID 22934041
N-(1-cyclopentylpiperidin-3-yl)-1H-indazole-5-carboxamide
CID 22933774
N-[(3S)-1-azabicyclo[5.2.0]nonan-3-yl]-1H-indazole-5-carboxamide
CID 67561766
N-[[2-(1H-indazole-5-carbonylamino)cyclopentyl]methyl]-1H-indazole-5-carboxamide
CID 154862895

Frequently Asked Questions

What is the IUPAC name of 3-(1H-indazole-5-carbonylamino)cyclopentane-1-carboxylic acid?
The IUPAC name of 3-(1H-indazole-5-carbonylamino)cyclopentane-1-carboxylic acid (CID 66030707) is 3-(1H-indazole-5-carbonylamino)cyclopentane-1-carboxylic acid.
What is the SMILES notation for 3-(1H-indazole-5-carbonylamino)cyclopentane-1-carboxylic acid?
The canonical SMILES for 3-(1H-indazole-5-carbonylamino)cyclopentane-1-carboxylic acid is O=C(NC1CCC(C(=O)O)C1)c1ccc2[nH]ncc2c1.
What is the InChIKey of 3-(1H-indazole-5-carbonylamino)cyclopentane-1-carboxylic acid?
The InChIKey is NWIJEPGXOOKGAQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N3O3/c18-13(16-11-3-1-9(6-11)14(19)20)8-2-4-12-10(5-8)7-15-17-12/h2,4-5,7,9,11H,1,3,6H2,(H,15,17)(H,16,18)(H,19,20).
What are the key properties of 3-(1H-indazole-5-carbonylamino)cyclopentane-1-carboxylic acid?
3-(1H-indazole-5-carbonylamino)cyclopentane-1-carboxylic acid has a molecular weight of 273.29 g/mol, XLogP of 1.55, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1H-indazole-5-carbonylamino)cyclopentane-1-carboxylic acid is sourced from PubChem (CID 66030707), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).