3-methyl-N-[6-(4-propan-2-ylphenyl)-1H-indazol-3-yl]piperidine-1-carboxamide

C23H28N4O — CID 58135508

IUPAC3-methyl-N-[6-(4-propan-2-ylphenyl)-1H-indazol-3-yl]piperidine-1-carboxamide
SMILESCC1CCCN(C(=O)Nc2n[nH]c3cc(-c4ccc(C(C)C)cc4)ccc23)C1
InChIInChI=1S/C23H28N4O/c1-15(2)17-6-8-18(9-7-17)19-10-11-20-21(13-19)25-26-22(20)24-23(28)27-12-4-5-16(3)14-27/h6-11,13,15-16H,4-5,12,14H2,1-3H3,(H2,24,25,26,28)
InChIKeyAEJXVNNBZJUCKG-UHFFFAOYSA-N
MW376.50 g/mol
LogP5.62
Rot. Bonds3

About 3-methyl-N-[6-(4-propan-2-ylphenyl)-1H-indazol-3-yl]piperidine-1-carboxamide

3-methyl-N-[6-(4-propan-2-ylphenyl)-1H-indazol-3-yl]piperidine-1-carboxamide (PubChem CID 58135508) has the molecular formula C23H28N4O and a molecular weight of 376.50 g/mol. Its IUPAC name is 3-methyl-N-[6-(4-propan-2-ylphenyl)-1H-indazol-3-yl]piperidine-1-carboxamide.

Molecular Properties

Compound Name3-methyl-N-[6-(4-propan-2-ylphenyl)-1H-indazol-3-yl]piperidine-1-carboxamide
PubChem CID58135508
Molecular FormulaC23H28N4O
Molecular Weight376.50 g/mol
Exact Mass376.23
IUPAC Name3-methyl-N-[6-(4-propan-2-ylphenyl)-1H-indazol-3-yl]piperidine-1-carboxamide
SMILESCC1CCCN(C(=O)Nc2n[nH]c3cc(-c4ccc(C(C)C)cc4)ccc23)C1
InChIInChI=1S/C23H28N4O/c1-15(2)17-6-8-18(9-7-17)19-10-11-20-21(13-19)25-26-22(20)24-23(28)27-12-4-5-16(3)14-27/h6-11,13,15-16H,4-5,12,14H2,1-3H3,(H2,24,25,26,28)
InChIKeyAEJXVNNBZJUCKG-UHFFFAOYSA-N
XLogP5.62
TPSA61.02 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500376.50
LogP ≤ 55.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 3-methyl-N-[6-(4-propan-2-ylphenyl)-1H-indazol-3-yl]piperidine-1-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-[6-(4-fluorophenyl)-1H-indazol-3-yl]-4-methylpiperidine-1-carboxamide
CID 58135453
N-[6-(4-methylphenyl)-1H-indazol-3-yl]piperazine-1-carboxamide
CID 69063807
4-hydroxy-N-[6-(4-methoxyphenyl)-1H-indazol-3-yl]piperidine-1-carboxamide
CID 69061015
1-N-[6-(3,5-dimethylphenyl)-1H-indazol-3-yl]-3-N,3-N-diethylpiperidine-1,3-dicarboxamide
CID 50943435
3-methyl-N-(3-propan-2-ylphenyl)piperidine-1-carboxamide
CID 47199347
1-[6-(4-methoxyphenyl)-1H-indazol-3-yl]-3-propan-2-ylurea
CID 69070012
N-(6-phenyl-1H-indazol-3-yl)cyclohexanecarboxamide
CID 69063558
2-cyclopentyl-N-[6-(4-methylphenyl)-1H-indazol-3-yl]acetamide
CID 69061785
N-[6-(4-ethylsulfanylphenyl)-1H-indazol-3-yl]cyclobutanecarboxamide
CID 69062286
2-methyl-N-(6-phenyl-1H-indazol-3-yl)butanamide
CID 69062252
N-[6-(3-cyanophenyl)-1H-indazol-3-yl]-3-methyl-4-(3-methylphenyl)piperazine-1-carboxamide
CID 50943508
N-[6-(4-methoxyphenyl)-1H-indazol-3-yl]-4-pyridin-2-ylpiperazine-1-carboxamide
CID 69062932

Frequently Asked Questions

What is the IUPAC name of 3-methyl-N-[6-(4-propan-2-ylphenyl)-1H-indazol-3-yl]piperidine-1-carboxamide?
The IUPAC name of 3-methyl-N-[6-(4-propan-2-ylphenyl)-1H-indazol-3-yl]piperidine-1-carboxamide (CID 58135508) is 3-methyl-N-[6-(4-propan-2-ylphenyl)-1H-indazol-3-yl]piperidine-1-carboxamide.
What is the SMILES notation for 3-methyl-N-[6-(4-propan-2-ylphenyl)-1H-indazol-3-yl]piperidine-1-carboxamide?
The canonical SMILES for 3-methyl-N-[6-(4-propan-2-ylphenyl)-1H-indazol-3-yl]piperidine-1-carboxamide is CC1CCCN(C(=O)Nc2n[nH]c3cc(-c4ccc(C(C)C)cc4)ccc23)C1.
What is the InChIKey of 3-methyl-N-[6-(4-propan-2-ylphenyl)-1H-indazol-3-yl]piperidine-1-carboxamide?
The InChIKey is AEJXVNNBZJUCKG-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H28N4O/c1-15(2)17-6-8-18(9-7-17)19-10-11-20-21(13-19)25-26-22(20)24-23(28)27-12-4-5-16(3)14-27/h6-11,13,15-16H,4-5,12,14H2,1-3H3,(H2,24,25,26,28).
What are the key properties of 3-methyl-N-[6-(4-propan-2-ylphenyl)-1H-indazol-3-yl]piperidine-1-carboxamide?
3-methyl-N-[6-(4-propan-2-ylphenyl)-1H-indazol-3-yl]piperidine-1-carboxamide has a molecular weight of 376.50 g/mol, XLogP of 5.62, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-N-[6-(4-propan-2-ylphenyl)-1H-indazol-3-yl]piperidine-1-carboxamide is sourced from PubChem (CID 58135508), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).