N-(1-methylindol-6-yl)-2-(4-methylphenyl)-3-oxo-1H-pyrazole-5-carboxamide

C20H18N4O2 — CID 71866929

IUPACN-(1-methylindol-6-yl)-2-(4-methylphenyl)-3-oxo-1H-pyrazole-5-carboxamide
SMILESCc1ccc(-n2[nH]c(C(=O)Nc3ccc4ccn(C)c4c3)cc2=O)cc1
InChIInChI=1S/C20H18N4O2/c1-13-3-7-16(8-4-13)24-19(25)12-17(22-24)20(26)21-15-6-5-14-9-10-23(2)18(14)11-15/h3-12,22H,1-2H3,(H,21,26)
InChIKeyFZGIZTXJERLXDI-UHFFFAOYSA-N
MW346.39 g/mol
LogP3.22
Rot. Bonds3

About N-(1-methylindol-6-yl)-2-(4-methylphenyl)-3-oxo-1H-pyrazole-5-carboxamide

N-(1-methylindol-6-yl)-2-(4-methylphenyl)-3-oxo-1H-pyrazole-5-carboxamide (PubChem CID 71866929) has the molecular formula C20H18N4O2 and a molecular weight of 346.39 g/mol. Its IUPAC name is N-(1-methylindol-6-yl)-2-(4-methylphenyl)-3-oxo-1H-pyrazole-5-carboxamide.

Molecular Properties

Compound NameN-(1-methylindol-6-yl)-2-(4-methylphenyl)-3-oxo-1H-pyrazole-5-carboxamide
PubChem CID71866929
Molecular FormulaC20H18N4O2
Molecular Weight346.39 g/mol
Exact Mass346.14
IUPAC NameN-(1-methylindol-6-yl)-2-(4-methylphenyl)-3-oxo-1H-pyrazole-5-carboxamide
SMILESCc1ccc(-n2[nH]c(C(=O)Nc3ccc4ccn(C)c4c3)cc2=O)cc1
InChIInChI=1S/C20H18N4O2/c1-13-3-7-16(8-4-13)24-19(25)12-17(22-24)20(26)21-15-6-5-14-9-10-23(2)18(14)11-15/h3-12,22H,1-2H3,(H,21,26)
InChIKeyFZGIZTXJERLXDI-UHFFFAOYSA-N
XLogP3.22
TPSA71.82 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.39
LogP ≤ 53.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-(1-methylindol-6-yl)-2-(4-methylphenyl)-3-oxo-1H-pyrazole-5-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-[3-hydroxy-2-(1-methylindol-6-yl)isoindol-5-yl]benzamide
CID 91411221
2-(4-methylphenyl)-3-oxo-N-(2-piperazin-1-ylethyl)-1H-pyrazole-5-carboxamide;hydrochloride
CID 119448604
N-[2-(1-methylindol-6-yl)-3-oxo-1H-isoindol-5-yl]benzamide
CID 59543297
N-(1-methylindol-6-yl)-4-(2-propan-2-yltetrazol-5-yl)benzamide
CID 75490589
N-(1-amino-2,3-dimethylbutan-2-yl)-2-(4-methylphenyl)-3-oxo-1H-pyrazole-5-carboxamide;hydrochloride
CID 119608497
N-(1-methylindol-6-yl)-2-(2-oxo-1,3-diazinan-1-yl)acetamide
CID 136526633
methyl 5-[(1-methylindol-6-yl)amino]-5-oxopentanoate
CID 75485035
4-(4,4-dioxo-1,4,3-oxathiazinan-3-yl)-2-methyl-N-(1-methylindol-6-yl)benzamide
CID 90130247
1-methyl-N-[1-(4-methylphenyl)-5-oxopyrrolidin-3-yl]indole-6-carboxamide
CID 72876504
N-[(1-methylindol-6-yl)amino]formamide
CID 174642732
2-[(4R)-2,5-dioxo-1-(2-phenylethyl)imidazolidin-4-yl]-N-(1-methylindol-6-yl)acetamide
CID 99871318
4-tert-butyl-N-(1-methylindol-5-yl)benzamide
CID 70990201

Frequently Asked Questions

What is the IUPAC name of N-(1-methylindol-6-yl)-2-(4-methylphenyl)-3-oxo-1H-pyrazole-5-carboxamide?
The IUPAC name of N-(1-methylindol-6-yl)-2-(4-methylphenyl)-3-oxo-1H-pyrazole-5-carboxamide (CID 71866929) is N-(1-methylindol-6-yl)-2-(4-methylphenyl)-3-oxo-1H-pyrazole-5-carboxamide.
What is the SMILES notation for N-(1-methylindol-6-yl)-2-(4-methylphenyl)-3-oxo-1H-pyrazole-5-carboxamide?
The canonical SMILES for N-(1-methylindol-6-yl)-2-(4-methylphenyl)-3-oxo-1H-pyrazole-5-carboxamide is Cc1ccc(-n2[nH]c(C(=O)Nc3ccc4ccn(C)c4c3)cc2=O)cc1.
What is the InChIKey of N-(1-methylindol-6-yl)-2-(4-methylphenyl)-3-oxo-1H-pyrazole-5-carboxamide?
The InChIKey is FZGIZTXJERLXDI-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18N4O2/c1-13-3-7-16(8-4-13)24-19(25)12-17(22-24)20(26)21-15-6-5-14-9-10-23(2)18(14)11-15/h3-12,22H,1-2H3,(H,21,26).
What are the key properties of N-(1-methylindol-6-yl)-2-(4-methylphenyl)-3-oxo-1H-pyrazole-5-carboxamide?
N-(1-methylindol-6-yl)-2-(4-methylphenyl)-3-oxo-1H-pyrazole-5-carboxamide has a molecular weight of 346.39 g/mol, XLogP of 3.22, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-methylindol-6-yl)-2-(4-methylphenyl)-3-oxo-1H-pyrazole-5-carboxamide is sourced from PubChem (CID 71866929), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).