3-(4-methylphenyl)-N-(1-phenylpyrazol-3-yl)propanamide

C19H19N3O — CID 55536355

IUPAC3-(4-methylphenyl)-N-(1-phenylpyrazol-3-yl)propanamide
SMILESCc1ccc(CCC(=O)Nc2ccn(-c3ccccc3)n2)cc1
InChIInChI=1S/C19H19N3O/c1-15-7-9-16(10-8-15)11-12-19(23)20-18-13-14-22(21-18)17-5-3-2-4-6-17/h2-10,13-14H,11-12H2,1H3,(H,20,21,23)
InChIKeyLVCNPPNUCRWHRD-UHFFFAOYSA-N
MW305.38 g/mol
LogP3.75
Rot. Bonds5

About 3-(4-methylphenyl)-N-(1-phenylpyrazol-3-yl)propanamide

3-(4-methylphenyl)-N-(1-phenylpyrazol-3-yl)propanamide (PubChem CID 55536355) has the molecular formula C19H19N3O and a molecular weight of 305.38 g/mol. Its IUPAC name is 3-(4-methylphenyl)-N-(1-phenylpyrazol-3-yl)propanamide.

Molecular Properties

Compound Name3-(4-methylphenyl)-N-(1-phenylpyrazol-3-yl)propanamide
PubChem CID55536355
Molecular FormulaC19H19N3O
Molecular Weight305.38 g/mol
Exact Mass305.15
IUPAC Name3-(4-methylphenyl)-N-(1-phenylpyrazol-3-yl)propanamide
SMILESCc1ccc(CCC(=O)Nc2ccn(-c3ccccc3)n2)cc1
InChIInChI=1S/C19H19N3O/c1-15-7-9-16(10-8-15)11-12-19(23)20-18-13-14-22(21-18)17-5-3-2-4-6-17/h2-10,13-14H,11-12H2,1H3,(H,20,21,23)
InChIKeyLVCNPPNUCRWHRD-UHFFFAOYSA-N
XLogP3.75
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.38
LogP ≤ 53.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-(3-methylphenyl)-N-(1-phenylpyrazol-3-yl)propanamide
CID 55547813
4-(4-chlorophenyl)-N-(1-phenylpyrazol-3-yl)butanamide
CID 55775808
3-(4-methylphenyl)-N-phenylpropanamide
CID 2995602
3-methyl-N-(1-phenylpyrazol-3-yl)butanamide
CID 110470740
2-(3,4-dimethoxyphenyl)-N-(1-phenylpyrazol-3-yl)acetamide
CID 135315862
N-(4-methylphenyl)-3-phenylpropanamide
CID 778861
2-(1-methylpyrrol-2-yl)-N-(1-phenylpyrazol-3-yl)acetamide
CID 135315845
N-[3,5-dimethyl-1-[(4-methylphenyl)methyl]pyrazol-4-yl]-3-phenylpropanamide
CID 19337840
5-ethyl-1-(4-methylphenyl)-N-(1-phenylpyrazol-3-yl)pyrazole-4-carboxamide
CID 55580357
N-[1-[(4-chlorophenyl)methyl]pyrazol-3-yl]-3-phenylpropanamide
CID 19283649
N,3-bis(4-methylphenyl)propanamide
CID 19220434
2-(3-fluoro-4-methoxyphenyl)-N-(1-phenylpyrazol-3-yl)acetamide
CID 135315910

Frequently Asked Questions

What is the IUPAC name of 3-(4-methylphenyl)-N-(1-phenylpyrazol-3-yl)propanamide?
The IUPAC name of 3-(4-methylphenyl)-N-(1-phenylpyrazol-3-yl)propanamide (CID 55536355) is 3-(4-methylphenyl)-N-(1-phenylpyrazol-3-yl)propanamide.
What is the SMILES notation for 3-(4-methylphenyl)-N-(1-phenylpyrazol-3-yl)propanamide?
The canonical SMILES for 3-(4-methylphenyl)-N-(1-phenylpyrazol-3-yl)propanamide is Cc1ccc(CCC(=O)Nc2ccn(-c3ccccc3)n2)cc1.
What is the InChIKey of 3-(4-methylphenyl)-N-(1-phenylpyrazol-3-yl)propanamide?
The InChIKey is LVCNPPNUCRWHRD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N3O/c1-15-7-9-16(10-8-15)11-12-19(23)20-18-13-14-22(21-18)17-5-3-2-4-6-17/h2-10,13-14H,11-12H2,1H3,(H,20,21,23).
What are the key properties of 3-(4-methylphenyl)-N-(1-phenylpyrazol-3-yl)propanamide?
3-(4-methylphenyl)-N-(1-phenylpyrazol-3-yl)propanamide has a molecular weight of 305.38 g/mol, XLogP of 3.75, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-methylphenyl)-N-(1-phenylpyrazol-3-yl)propanamide is sourced from PubChem (CID 55536355), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).