1-phenyl-N-propan-2-yl-4,5,6,7-tetrahydroindazole-3-carboxamide

C17H21N3O — CID 110374225

IUPAC1-phenyl-N-propan-2-yl-4,5,6,7-tetrahydroindazole-3-carboxamide
SMILESCC(C)NC(=O)c1nn(-c2ccccc2)c2c1CCCC2
InChIInChI=1S/C17H21N3O/c1-12(2)18-17(21)16-14-10-6-7-11-15(14)20(19-16)13-8-4-3-5-9-13/h3-5,8-9,12H,6-7,10-11H2,1-2H3,(H,18,21)
InChIKeyXJLVUWCEQUGAQG-UHFFFAOYSA-N
MW283.38 g/mol
LogP2.89
Rot. Bonds3

About 1-phenyl-N-propan-2-yl-4,5,6,7-tetrahydroindazole-3-carboxamide

1-phenyl-N-propan-2-yl-4,5,6,7-tetrahydroindazole-3-carboxamide (PubChem CID 110374225) has the molecular formula C17H21N3O and a molecular weight of 283.38 g/mol. Its IUPAC name is 1-phenyl-N-propan-2-yl-4,5,6,7-tetrahydroindazole-3-carboxamide.

Molecular Properties

Compound Name1-phenyl-N-propan-2-yl-4,5,6,7-tetrahydroindazole-3-carboxamide
PubChem CID110374225
Molecular FormulaC17H21N3O
Molecular Weight283.38 g/mol
Exact Mass283.17
IUPAC Name1-phenyl-N-propan-2-yl-4,5,6,7-tetrahydroindazole-3-carboxamide
SMILESCC(C)NC(=O)c1nn(-c2ccccc2)c2c1CCCC2
InChIInChI=1S/C17H21N3O/c1-12(2)18-17(21)16-14-10-6-7-11-15(14)20(19-16)13-8-4-3-5-9-13/h3-5,8-9,12H,6-7,10-11H2,1-2H3,(H,18,21)
InChIKeyXJLVUWCEQUGAQG-UHFFFAOYSA-N
XLogP2.89
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.38
LogP ≤ 52.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-phenyl-N-propan-2-yl-4,5,6,7-tetrahydroindazole-3-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

N-[1-(2-methylphenyl)ethyl]-1-phenyl-5,6-dihydro-4H-cyclopenta[d]pyrazole-3-carboxamide
CID 42929738
N-[1-(4-fluorophenyl)ethyl]-1-phenyl-5,6-dihydro-4H-cyclopenta[d]pyrazole-3-carboxamide
CID 42929735
2-[(1-phenyl-4,5,6,7-tetrahydroindazole-3-carbonyl)amino]acetic acid
CID 175587571
N-[(1S)-2-amino-2-oxo-1-phenylethyl]-1-phenyl-5,6-dihydro-4H-cyclopenta[d]pyrazole-3-carboxamide
CID 51475399
2-[[1-(4-bromophenyl)-4,5,6,7-tetrahydroindazole-3-carbonyl]amino]propanoic acid
CID 119225220
N-[(1R)-1-(3,4-difluorophenyl)ethyl]-1-phenyl-5,6-dihydro-4H-cyclopenta[d]pyrazole-3-carboxamide
CID 25491200
N-(3-hydroxybutan-2-yl)-1-(4-methylphenyl)-4,5,6,7-tetrahydroindazole-3-carboxamide
CID 146126250
N'-benzoyl-1-phenyl-5,6-dihydro-4H-cyclopenta[d]pyrazole-3-carbohydrazide
CID 46682483
N-(2-hydroxyethyl)-1-phenyl-5,6,7,8-tetrahydro-4H-cyclohepta[d]pyrazole-3-carboxamide
CID 78888197
N-(3-methoxypropyl)-1-phenyl-5,6-dihydro-4H-cyclopenta[d]pyrazole-3-carboxamide
CID 30098859
N-benzyl-1-phenyl-5,6-dihydro-4H-cyclopenta[d]pyrazole-3-carboxamide
CID 17492126
N-(2-morpholin-4-ylpropyl)-1-phenyl-5,6,7,8-tetrahydro-4H-cyclohepta[d]pyrazole-3-carboxamide
CID 55775104

Frequently Asked Questions

What is the IUPAC name of 1-phenyl-N-propan-2-yl-4,5,6,7-tetrahydroindazole-3-carboxamide?
The IUPAC name of 1-phenyl-N-propan-2-yl-4,5,6,7-tetrahydroindazole-3-carboxamide (CID 110374225) is 1-phenyl-N-propan-2-yl-4,5,6,7-tetrahydroindazole-3-carboxamide.
What is the SMILES notation for 1-phenyl-N-propan-2-yl-4,5,6,7-tetrahydroindazole-3-carboxamide?
The canonical SMILES for 1-phenyl-N-propan-2-yl-4,5,6,7-tetrahydroindazole-3-carboxamide is CC(C)NC(=O)c1nn(-c2ccccc2)c2c1CCCC2.
What is the InChIKey of 1-phenyl-N-propan-2-yl-4,5,6,7-tetrahydroindazole-3-carboxamide?
The InChIKey is XJLVUWCEQUGAQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21N3O/c1-12(2)18-17(21)16-14-10-6-7-11-15(14)20(19-16)13-8-4-3-5-9-13/h3-5,8-9,12H,6-7,10-11H2,1-2H3,(H,18,21).
What are the key properties of 1-phenyl-N-propan-2-yl-4,5,6,7-tetrahydroindazole-3-carboxamide?
1-phenyl-N-propan-2-yl-4,5,6,7-tetrahydroindazole-3-carboxamide has a molecular weight of 283.38 g/mol, XLogP of 2.89, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-phenyl-N-propan-2-yl-4,5,6,7-tetrahydroindazole-3-carboxamide is sourced from PubChem (CID 110374225), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).