N-[1-[(3-chlorophenyl)methyl]pyrazol-3-yl]-3-phenylpropanamide

C19H18ClN3O — CID 19403070

IUPACN-[1-[(3-chlorophenyl)methyl]pyrazol-3-yl]-3-phenylpropanamide
SMILESO=C(CCc1ccccc1)Nc1ccn(Cc2cccc(Cl)c2)n1
InChIInChI=1S/C19H18ClN3O/c20-17-8-4-7-16(13-17)14-23-12-11-18(22-23)21-19(24)10-9-15-5-2-1-3-6-15/h1-8,11-13H,9-10,14H2,(H,21,22,24)
InChIKeyPDIGBJQYRJNXTH-UHFFFAOYSA-N
MW339.83 g/mol
LogP4.16
Rot. Bonds6

About N-[1-[(3-chlorophenyl)methyl]pyrazol-3-yl]-3-phenylpropanamide

N-[1-[(3-chlorophenyl)methyl]pyrazol-3-yl]-3-phenylpropanamide (PubChem CID 19403070) has the molecular formula C19H18ClN3O and a molecular weight of 339.83 g/mol. Its IUPAC name is N-[1-[(3-chlorophenyl)methyl]pyrazol-3-yl]-3-phenylpropanamide.

Molecular Properties

Compound NameN-[1-[(3-chlorophenyl)methyl]pyrazol-3-yl]-3-phenylpropanamide
PubChem CID19403070
Molecular FormulaC19H18ClN3O
Molecular Weight339.83 g/mol
Exact Mass339.11
IUPAC NameN-[1-[(3-chlorophenyl)methyl]pyrazol-3-yl]-3-phenylpropanamide
SMILESO=C(CCc1ccccc1)Nc1ccn(Cc2cccc(Cl)c2)n1
InChIInChI=1S/C19H18ClN3O/c20-17-8-4-7-16(13-17)14-23-12-11-18(22-23)21-19(24)10-9-15-5-2-1-3-6-15/h1-8,11-13H,9-10,14H2,(H,21,22,24)
InChIKeyPDIGBJQYRJNXTH-UHFFFAOYSA-N
XLogP4.16
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.83
LogP ≤ 54.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-[1-[(3-chlorophenyl)methyl]pyrazol-3-yl]-3-phenylpropanamide 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-[(4-chlorophenyl)methyl]pyrazol-3-yl]-3-phenylpropanamide
CID 19283649
N-(1-benzylpyrazol-3-yl)-3-chlorobenzamide
CID 2991624
N-[1-[(3-chlorophenyl)methyl]pyrazol-3-yl]-2-(4-chloropyrazol-1-yl)acetamide
CID 19524979
N-[1-[(3-chlorophenyl)methyl]pyrazol-3-yl]-2-(2-methylphenoxy)acetamide
CID 19403248
4-bromo-N-[1-[(3-chlorophenyl)methyl]pyrazol-3-yl]benzamide
CID 19403078
2-[3,5-bis(difluoromethyl)pyrazol-1-yl]-N-[1-[(3-chlorophenyl)methyl]pyrazol-3-yl]acetamide
CID 19518157
N-(1-benzylpyrazol-3-yl)-3-(5-ethylfuran-2-yl)propanamide
CID 126420955
2-(4-chloro-5-methylpyrazol-1-yl)-N-[1-[(3-chlorophenyl)methyl]pyrazol-3-yl]acetamide
CID 19520712
N-[1-[(3-chlorophenyl)methyl]pyrazol-3-yl]-3-(3,5-dimethyl-4-nitropyrazol-1-yl)propanamide
CID 19557862
3-(3-chlorophenyl)-N-phenylpropanamide
CID 1407295
4,5-dibromo-N-[1-[(3-chlorophenyl)methyl]pyrazol-3-yl]-1H-pyrazole-3-carboxamide
CID 19508570
N-[1-[(3-chlorophenyl)methyl]pyrazol-3-yl]-4-nitrobenzamide
CID 19406942

Frequently Asked Questions

What is the IUPAC name of N-[1-[(3-chlorophenyl)methyl]pyrazol-3-yl]-3-phenylpropanamide?
The IUPAC name of N-[1-[(3-chlorophenyl)methyl]pyrazol-3-yl]-3-phenylpropanamide (CID 19403070) is N-[1-[(3-chlorophenyl)methyl]pyrazol-3-yl]-3-phenylpropanamide.
What is the SMILES notation for N-[1-[(3-chlorophenyl)methyl]pyrazol-3-yl]-3-phenylpropanamide?
The canonical SMILES for N-[1-[(3-chlorophenyl)methyl]pyrazol-3-yl]-3-phenylpropanamide is O=C(CCc1ccccc1)Nc1ccn(Cc2cccc(Cl)c2)n1.
What is the InChIKey of N-[1-[(3-chlorophenyl)methyl]pyrazol-3-yl]-3-phenylpropanamide?
The InChIKey is PDIGBJQYRJNXTH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18ClN3O/c20-17-8-4-7-16(13-17)14-23-12-11-18(22-23)21-19(24)10-9-15-5-2-1-3-6-15/h1-8,11-13H,9-10,14H2,(H,21,22,24).
What are the key properties of N-[1-[(3-chlorophenyl)methyl]pyrazol-3-yl]-3-phenylpropanamide?
N-[1-[(3-chlorophenyl)methyl]pyrazol-3-yl]-3-phenylpropanamide has a molecular weight of 339.83 g/mol, XLogP of 4.16, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-[(3-chlorophenyl)methyl]pyrazol-3-yl]-3-phenylpropanamide is sourced from PubChem (CID 19403070), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).