3-(4-ethylphenyl)-N-(5-methyl-1H-pyrazol-3-yl)propanamide

C15H19N3O — CID 47215997

IUPAC3-(4-ethylphenyl)-N-(5-methyl-1H-pyrazol-3-yl)propanamide
SMILESCCc1ccc(CCC(=O)Nc2cc(C)[nH]n2)cc1
InChIInChI=1S/C15H19N3O/c1-3-12-4-6-13(7-5-12)8-9-15(19)16-14-10-11(2)17-18-14/h4-7,10H,3,8-9H2,1-2H3,(H2,16,17,18,19)
InChIKeyXVKVSJVHQUZGJH-UHFFFAOYSA-N
MW257.34 g/mol
LogP2.85
Rot. Bonds5

About 3-(4-ethylphenyl)-N-(5-methyl-1H-pyrazol-3-yl)propanamide

3-(4-ethylphenyl)-N-(5-methyl-1H-pyrazol-3-yl)propanamide (PubChem CID 47215997) has the molecular formula C15H19N3O and a molecular weight of 257.34 g/mol. Its IUPAC name is 3-(4-ethylphenyl)-N-(5-methyl-1H-pyrazol-3-yl)propanamide.

Molecular Properties

Compound Name3-(4-ethylphenyl)-N-(5-methyl-1H-pyrazol-3-yl)propanamide
PubChem CID47215997
Molecular FormulaC15H19N3O
Molecular Weight257.34 g/mol
Exact Mass257.15
IUPAC Name3-(4-ethylphenyl)-N-(5-methyl-1H-pyrazol-3-yl)propanamide
SMILESCCc1ccc(CCC(=O)Nc2cc(C)[nH]n2)cc1
InChIInChI=1S/C15H19N3O/c1-3-12-4-6-13(7-5-12)8-9-15(19)16-14-10-11(2)17-18-14/h4-7,10H,3,8-9H2,1-2H3,(H2,16,17,18,19)
InChIKeyXVKVSJVHQUZGJH-UHFFFAOYSA-N
XLogP2.85
TPSA57.78 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.34
LogP ≤ 52.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-(4-hydroxyphenyl)-N-(5-methyl-1H-pyrazol-3-yl)propanamide
CID 110483845
[2-[(5-methyl-1H-pyrazol-3-yl)amino]-2-oxoethyl] 4-ethylbenzoate
CID 46860569
2-(4-butylphenyl)-N-(5-methyl-1H-pyrazol-3-yl)acetamide
CID 47289707
N-(5-ethyl-1H-pyrazol-3-yl)-3-pyridin-3-ylpropanamide
CID 47423313
3-(2-hydroxyphenyl)-N-(5-methyl-1H-pyrazol-3-yl)propanamide
CID 47215990
N-(5-methyl-1H-pyrazol-3-yl)nonanamide
CID 47289748
3-(3,4-dihydro-2H-chromen-6-yl)-N-(5-methyl-1H-pyrazol-3-yl)propanamide
CID 167758778
1-(4-ethylphenyl)-3-(5-methyl-1H-pyrazol-3-yl)thiourea
CID 17123887
(5-methyl-1H-pyrazol-3-yl)carbamic acid
CID 23091960
3-(2-aminophenyl)-N-(5-methyl-1H-pyrazol-3-yl)propanamide
CID 107273103
N-[5-[(dimethylamino)methyl]-1H-pyrazol-3-yl]-3-phenylpropanamide
CID 95755349
2-ethyl-N-(5-methyl-1H-pyrazol-3-yl)butanamide
CID 63820066

Frequently Asked Questions

What is the IUPAC name of 3-(4-ethylphenyl)-N-(5-methyl-1H-pyrazol-3-yl)propanamide?
The IUPAC name of 3-(4-ethylphenyl)-N-(5-methyl-1H-pyrazol-3-yl)propanamide (CID 47215997) is 3-(4-ethylphenyl)-N-(5-methyl-1H-pyrazol-3-yl)propanamide.
What is the SMILES notation for 3-(4-ethylphenyl)-N-(5-methyl-1H-pyrazol-3-yl)propanamide?
The canonical SMILES for 3-(4-ethylphenyl)-N-(5-methyl-1H-pyrazol-3-yl)propanamide is CCc1ccc(CCC(=O)Nc2cc(C)[nH]n2)cc1.
What is the InChIKey of 3-(4-ethylphenyl)-N-(5-methyl-1H-pyrazol-3-yl)propanamide?
The InChIKey is XVKVSJVHQUZGJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O/c1-3-12-4-6-13(7-5-12)8-9-15(19)16-14-10-11(2)17-18-14/h4-7,10H,3,8-9H2,1-2H3,(H2,16,17,18,19).
What are the key properties of 3-(4-ethylphenyl)-N-(5-methyl-1H-pyrazol-3-yl)propanamide?
3-(4-ethylphenyl)-N-(5-methyl-1H-pyrazol-3-yl)propanamide has a molecular weight of 257.34 g/mol, XLogP of 2.85, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-ethylphenyl)-N-(5-methyl-1H-pyrazol-3-yl)propanamide is sourced from PubChem (CID 47215997), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).