2-cyclopropyl-N-[(2-methyl-4-pyrazol-1-ylphenyl)methyl]propanamide

C17H21N3O — CID 136572601

IUPAC2-cyclopropyl-N-[(2-methyl-4-pyrazol-1-ylphenyl)methyl]propanamide
SMILESCc1cc(-n2cccn2)ccc1CNC(=O)C(C)C1CC1
InChIInChI=1S/C17H21N3O/c1-12-10-16(20-9-3-8-19-20)7-6-15(12)11-18-17(21)13(2)14-4-5-14/h3,6-10,13-14H,4-5,11H2,1-2H3,(H,18,21)
InChIKeyHUCQPCLYHPZTPT-UHFFFAOYSA-N
MW283.37 g/mol
LogP2.84
Rot. Bonds5

About 2-cyclopropyl-N-[(2-methyl-4-pyrazol-1-ylphenyl)methyl]propanamide

2-cyclopropyl-N-[(2-methyl-4-pyrazol-1-ylphenyl)methyl]propanamide (PubChem CID 136572601) has the molecular formula C17H21N3O and a molecular weight of 283.37 g/mol. Its IUPAC name is 2-cyclopropyl-N-[(2-methyl-4-pyrazol-1-ylphenyl)methyl]propanamide.

Molecular Properties

Compound Name2-cyclopropyl-N-[(2-methyl-4-pyrazol-1-ylphenyl)methyl]propanamide
PubChem CID136572601
Molecular FormulaC17H21N3O
Molecular Weight283.37 g/mol
Exact Mass283.17
IUPAC Name2-cyclopropyl-N-[(2-methyl-4-pyrazol-1-ylphenyl)methyl]propanamide
SMILESCc1cc(-n2cccn2)ccc1CNC(=O)C(C)C1CC1
InChIInChI=1S/C17H21N3O/c1-12-10-16(20-9-3-8-19-20)7-6-15(12)11-18-17(21)13(2)14-4-5-14/h3,6-10,13-14H,4-5,11H2,1-2H3,(H,18,21)
InChIKeyHUCQPCLYHPZTPT-UHFFFAOYSA-N
XLogP2.84
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.37
LogP ≤ 52.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-cyclopropyl-N-[(2-methyl-4-pyrazol-1-ylphenyl)methyl]propanamide 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

2-(azetidin-3-yl)-N-[(2-pyrazol-1-ylphenyl)methyl]propanamide
CID 116677047
3-(5-cyclopentyl-1,3,4-oxadiazol-2-yl)-N-[(2-methyl-4-pyrazol-1-ylphenyl)methyl]propanamide
CID 155956554
N-[(1R,2R)-2-methoxy-1'-[(2-methyl-4-pyrazol-1-ylphenyl)methyl]spiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]-2-methylpropanamide
CID 26275022
1-cyclopropyl-3-[(2-fluoro-4-pyrazol-1-ylphenyl)methyl]urea
CID 165120008
N-[(4-methoxy-2-methylphenyl)methyl]-2-(oxan-4-yl)propanamide
CID 75433024
N-[[4-[(Z)-N'-methoxycarbamimidoyl]-2-methylphenyl]methyl]-7-pyrazol-1-yl-9,10-dihydroanthracene-2-carboxamide
CID 145206952
2-methyl-3-(methylamino)-N-[(4-pyrazol-1-ylphenyl)methyl]propanamide;hydrochloride
CID 119725281
N-methyl-2-[2-(2-methyl-4-pyrazol-1-ylphenyl)ethyl]aniline
CID 155063541
N-[(4-fluoro-2-methylphenyl)methyl]-4-pyrazol-1-ylaniline
CID 62134405
N-[[1-[(2-methyl-4-pyrazol-1-ylphenyl)methyl]piperidin-3-yl]methyl]-1H-indazole-3-carboxamide
CID 45190792
2-methyl-5-pyrazol-1-ylbenzamide
CID 68604626
N-[(4-fluoro-2-methylphenyl)methyl]-3-pyrazol-1-ylaniline
CID 62134761

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-N-[(2-methyl-4-pyrazol-1-ylphenyl)methyl]propanamide?
The IUPAC name of 2-cyclopropyl-N-[(2-methyl-4-pyrazol-1-ylphenyl)methyl]propanamide (CID 136572601) is 2-cyclopropyl-N-[(2-methyl-4-pyrazol-1-ylphenyl)methyl]propanamide.
What is the SMILES notation for 2-cyclopropyl-N-[(2-methyl-4-pyrazol-1-ylphenyl)methyl]propanamide?
The canonical SMILES for 2-cyclopropyl-N-[(2-methyl-4-pyrazol-1-ylphenyl)methyl]propanamide is Cc1cc(-n2cccn2)ccc1CNC(=O)C(C)C1CC1.
What is the InChIKey of 2-cyclopropyl-N-[(2-methyl-4-pyrazol-1-ylphenyl)methyl]propanamide?
The InChIKey is HUCQPCLYHPZTPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21N3O/c1-12-10-16(20-9-3-8-19-20)7-6-15(12)11-18-17(21)13(2)14-4-5-14/h3,6-10,13-14H,4-5,11H2,1-2H3,(H,18,21).
What are the key properties of 2-cyclopropyl-N-[(2-methyl-4-pyrazol-1-ylphenyl)methyl]propanamide?
2-cyclopropyl-N-[(2-methyl-4-pyrazol-1-ylphenyl)methyl]propanamide has a molecular weight of 283.37 g/mol, XLogP of 2.84, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-N-[(2-methyl-4-pyrazol-1-ylphenyl)methyl]propanamide is sourced from PubChem (CID 136572601), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).