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

C13H15N3O2 — CID 110483845

IUPAC3-(4-hydroxyphenyl)-N-(5-methyl-1H-pyrazol-3-yl)propanamide
SMILESCc1cc(NC(=O)CCc2ccc(O)cc2)n[nH]1
InChIInChI=1S/C13H15N3O2/c1-9-8-12(16-15-9)14-13(18)7-4-10-2-5-11(17)6-3-10/h2-3,5-6,8,17H,4,7H2,1H3,(H2,14,15,16,18)
InChIKeyBUKVCGITTRBBLD-UHFFFAOYSA-N
MW245.28 g/mol
LogP2.00
Rot. Bonds4

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

3-(4-hydroxyphenyl)-N-(5-methyl-1H-pyrazol-3-yl)propanamide (PubChem CID 110483845) has the molecular formula C13H15N3O2 and a molecular weight of 245.28 g/mol. Its IUPAC name is 3-(4-hydroxyphenyl)-N-(5-methyl-1H-pyrazol-3-yl)propanamide.

Molecular Properties

Compound Name3-(4-hydroxyphenyl)-N-(5-methyl-1H-pyrazol-3-yl)propanamide
PubChem CID110483845
Molecular FormulaC13H15N3O2
Molecular Weight245.28 g/mol
Exact Mass245.12
IUPAC Name3-(4-hydroxyphenyl)-N-(5-methyl-1H-pyrazol-3-yl)propanamide
SMILESCc1cc(NC(=O)CCc2ccc(O)cc2)n[nH]1
InChIInChI=1S/C13H15N3O2/c1-9-8-12(16-15-9)14-13(18)7-4-10-2-5-11(17)6-3-10/h2-3,5-6,8,17H,4,7H2,1H3,(H2,14,15,16,18)
InChIKeyBUKVCGITTRBBLD-UHFFFAOYSA-N
XLogP2.00
TPSA78.01 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.28
LogP ≤ 52.00
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

3-(4-ethylphenyl)-N-(5-methyl-1H-pyrazol-3-yl)propanamide
CID 47215997
3-(2-hydroxyphenyl)-N-(5-methyl-1H-pyrazol-3-yl)propanamide
CID 47215990
2-(4-butylphenyl)-N-(5-methyl-1H-pyrazol-3-yl)acetamide
CID 47289707
3-(3,4-dihydro-2H-chromen-6-yl)-N-(5-methyl-1H-pyrazol-3-yl)propanamide
CID 167758778
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
N-(5-methyl-1H-pyrazol-3-yl)nonanamide
CID 47289748
3-(4-hydroxyphenyl)-N-(1H-pyrazol-5-yl)propanamide
CID 110483844
(5-methyl-1H-pyrazol-3-yl)carbamic acid
CID 23091960
3-(4,6-dimethyl-2-methylsulfanylpyrimidin-5-yl)-N-(5-methyl-1H-pyrazol-3-yl)propanamide
CID 47038591
1-(5-methyl-1H-pyrazol-3-yl)-3-[4-(3-oxo-3-pyrrolidin-1-ylpropyl)phenyl]urea
CID 99835760
3-[5-(4-methylphenyl)-1,3-oxazol-2-yl]-N-(5-methyl-1H-pyrazol-3-yl)propanamide
CID 55867560

Frequently Asked Questions

What is the IUPAC name of 3-(4-hydroxyphenyl)-N-(5-methyl-1H-pyrazol-3-yl)propanamide?
The IUPAC name of 3-(4-hydroxyphenyl)-N-(5-methyl-1H-pyrazol-3-yl)propanamide (CID 110483845) is 3-(4-hydroxyphenyl)-N-(5-methyl-1H-pyrazol-3-yl)propanamide.
What is the SMILES notation for 3-(4-hydroxyphenyl)-N-(5-methyl-1H-pyrazol-3-yl)propanamide?
The canonical SMILES for 3-(4-hydroxyphenyl)-N-(5-methyl-1H-pyrazol-3-yl)propanamide is Cc1cc(NC(=O)CCc2ccc(O)cc2)n[nH]1.
What is the InChIKey of 3-(4-hydroxyphenyl)-N-(5-methyl-1H-pyrazol-3-yl)propanamide?
The InChIKey is BUKVCGITTRBBLD-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N3O2/c1-9-8-12(16-15-9)14-13(18)7-4-10-2-5-11(17)6-3-10/h2-3,5-6,8,17H,4,7H2,1H3,(H2,14,15,16,18).
What are the key properties of 3-(4-hydroxyphenyl)-N-(5-methyl-1H-pyrazol-3-yl)propanamide?
3-(4-hydroxyphenyl)-N-(5-methyl-1H-pyrazol-3-yl)propanamide has a molecular weight of 245.28 g/mol, XLogP of 2.00, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-hydroxyphenyl)-N-(5-methyl-1H-pyrazol-3-yl)propanamide is sourced from PubChem (CID 110483845), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).