N-(1H-indazol-5-yl)cyclohexanecarboxamide

C14H17N3O — CID 3523119

IUPACN-(1H-indazol-5-yl)cyclohexanecarboxamide
SMILESO=C(Nc1ccc2[nH]ncc2c1)C1CCCCC1
InChIInChI=1S/C14H17N3O/c18-14(10-4-2-1-3-5-10)16-12-6-7-13-11(8-12)9-15-17-13/h6-10H,1-5H2,(H,15,17)(H,16,18)
InChIKeyDAGIQWKGXGQHPJ-UHFFFAOYSA-N
MW243.31 g/mol
LogP3.08
Rot. Bonds2

About N-(1H-indazol-5-yl)cyclohexanecarboxamide

N-(1H-indazol-5-yl)cyclohexanecarboxamide (PubChem CID 3523119) has the molecular formula C14H17N3O and a molecular weight of 243.31 g/mol. Its IUPAC name is N-(1H-indazol-5-yl)cyclohexanecarboxamide.

Molecular Properties

Compound NameN-(1H-indazol-5-yl)cyclohexanecarboxamide
PubChem CID3523119
Molecular FormulaC14H17N3O
Molecular Weight243.31 g/mol
Exact Mass243.14
IUPAC NameN-(1H-indazol-5-yl)cyclohexanecarboxamide
SMILESO=C(Nc1ccc2[nH]ncc2c1)C1CCCCC1
InChIInChI=1S/C14H17N3O/c18-14(10-4-2-1-3-5-10)16-12-6-7-13-11(8-12)9-15-17-13/h6-10H,1-5H2,(H,15,17)(H,16,18)
InChIKeyDAGIQWKGXGQHPJ-UHFFFAOYSA-N
XLogP3.08
TPSA57.78 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.31
LogP ≤ 53.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze N-(1H-indazol-5-yl)cyclohexanecarboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-(1H-indazol-5-yl)cyclohexanecarboxamide?
The IUPAC name of N-(1H-indazol-5-yl)cyclohexanecarboxamide (CID 3523119) is N-(1H-indazol-5-yl)cyclohexanecarboxamide.
What is the SMILES notation for N-(1H-indazol-5-yl)cyclohexanecarboxamide?
The canonical SMILES for N-(1H-indazol-5-yl)cyclohexanecarboxamide is O=C(Nc1ccc2[nH]ncc2c1)C1CCCCC1.
What is the InChIKey of N-(1H-indazol-5-yl)cyclohexanecarboxamide?
The InChIKey is DAGIQWKGXGQHPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3O/c18-14(10-4-2-1-3-5-10)16-12-6-7-13-11(8-12)9-15-17-13/h6-10H,1-5H2,(H,15,17)(H,16,18).
What are the key properties of N-(1H-indazol-5-yl)cyclohexanecarboxamide?
N-(1H-indazol-5-yl)cyclohexanecarboxamide has a molecular weight of 243.31 g/mol, XLogP of 3.08, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1H-indazol-5-yl)cyclohexanecarboxamide is sourced from PubChem (CID 3523119), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).