3-(4-chlorophenyl)-4,5,6,7-tetrahydro-1H-indazole-7-carboxamide

C14H14ClN3O — CID 118738000

IUPAC3-(4-chlorophenyl)-4,5,6,7-tetrahydro-1H-indazole-7-carboxamide
SMILESNC(=O)C1CCCc2c(-c3ccc(Cl)cc3)n[nH]c21
InChIInChI=1S/C14H14ClN3O/c15-9-6-4-8(5-7-9)12-10-2-1-3-11(14(16)19)13(10)18-17-12/h4-7,11H,1-3H2,(H2,16,19)(H,17,18)
InChIKeyDJSXAFBEVHGPLR-UHFFFAOYSA-N
MW275.74 g/mol
LogP2.64
Rot. Bonds2

About 3-(4-chlorophenyl)-4,5,6,7-tetrahydro-1H-indazole-7-carboxamide

3-(4-chlorophenyl)-4,5,6,7-tetrahydro-1H-indazole-7-carboxamide (PubChem CID 118738000) has the molecular formula C14H14ClN3O and a molecular weight of 275.74 g/mol. Its IUPAC name is 3-(4-chlorophenyl)-4,5,6,7-tetrahydro-1H-indazole-7-carboxamide.

Molecular Properties

Compound Name3-(4-chlorophenyl)-4,5,6,7-tetrahydro-1H-indazole-7-carboxamide
PubChem CID118738000
Molecular FormulaC14H14ClN3O
Molecular Weight275.74 g/mol
Exact Mass275.08
IUPAC Name3-(4-chlorophenyl)-4,5,6,7-tetrahydro-1H-indazole-7-carboxamide
SMILESNC(=O)C1CCCc2c(-c3ccc(Cl)cc3)n[nH]c21
InChIInChI=1S/C14H14ClN3O/c15-9-6-4-8(5-7-9)12-10-2-1-3-11(14(16)19)13(10)18-17-12/h4-7,11H,1-3H2,(H2,16,19)(H,17,18)
InChIKeyDJSXAFBEVHGPLR-UHFFFAOYSA-N
XLogP2.64
TPSA71.77 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.74
LogP ≤ 52.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 3-(4-chlorophenyl)-4,5,6,7-tetrahydro-1H-indazole-7-carboxamide with MolForge

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

Launch Full Analysis

Related Compounds

(E)-N'-(4-chlorobenzylidene)-4,5,6,7-tetrahydro-1H-indazole-3-carbohydrazide
CID 6861960
3-(4-chlorophenyl)-4,5,6,7-tetrahydro-1H-indazole
CID 2767228
3-(4-Chlorophenyl)-1,4,5,6,7,8-hexahydrocyclohepta[d]pyrazole-8-carboxamide
CID 118738024
3-(4-Chlorophenyl)-5,5-dimethyl-1,4,6,7-tetrahydroindazole-7-carboxamide
CID 118738026
3-(4-chloro-1H-indazol-3-yl)benzamide
CID 118712907
3-(3,4-dichlorophenyl)-4,5,6,7-tetrahydro-1H-indazole-7-carboxamide
CID 118738004
3-(4-chloro-3-fluorophenyl)-4,5,6,7-tetrahydro-1H-indazole-7-carboxamide
CID 118738006
3-(4-bromophenyl)-4,5,6,7-tetrahydro-1H-indazole-7-carboxamide
CID 118738008
3-(4-methylphenyl)-4,5,6,7-tetrahydro-1H-indazole-7-carboxamide
CID 118738010
2-(5-Chloro-1H-Indazol-3-Yl)-Acetamide
CID 70827781
3-phenyl-4,5,6,7-tetrahydro-1H-indazole-7-carboxamide
CID 118737999
3-(4-chlorophenyl)-N-methyl-4,5,6,7-tetrahydro-1H-indazole-7-carboxamide
CID 118738001

Frequently Asked Questions

What is the IUPAC name of 3-(4-chlorophenyl)-4,5,6,7-tetrahydro-1H-indazole-7-carboxamide?
The IUPAC name of 3-(4-chlorophenyl)-4,5,6,7-tetrahydro-1H-indazole-7-carboxamide (CID 118738000) is 3-(4-chlorophenyl)-4,5,6,7-tetrahydro-1H-indazole-7-carboxamide.
What is the SMILES notation for 3-(4-chlorophenyl)-4,5,6,7-tetrahydro-1H-indazole-7-carboxamide?
The canonical SMILES for 3-(4-chlorophenyl)-4,5,6,7-tetrahydro-1H-indazole-7-carboxamide is NC(=O)C1CCCc2c(-c3ccc(Cl)cc3)n[nH]c21.
What is the InChIKey of 3-(4-chlorophenyl)-4,5,6,7-tetrahydro-1H-indazole-7-carboxamide?
The InChIKey is DJSXAFBEVHGPLR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14ClN3O/c15-9-6-4-8(5-7-9)12-10-2-1-3-11(14(16)19)13(10)18-17-12/h4-7,11H,1-3H2,(H2,16,19)(H,17,18).
What are the key properties of 3-(4-chlorophenyl)-4,5,6,7-tetrahydro-1H-indazole-7-carboxamide?
3-(4-chlorophenyl)-4,5,6,7-tetrahydro-1H-indazole-7-carboxamide has a molecular weight of 275.74 g/mol, XLogP of 2.64, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-chlorophenyl)-4,5,6,7-tetrahydro-1H-indazole-7-carboxamide is sourced from PubChem (CID 118738000), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).