3-(2-hydroxyphenyl)-N-(5-methyl-1H-pyrazol-3-yl)propanamide

C13H15N3O2 — CID 47215990

IUPAC3-(2-hydroxyphenyl)-N-(5-methyl-1H-pyrazol-3-yl)propanamide
SMILESCc1cc(NC(=O)CCc2ccccc2O)n[nH]1
InChIInChI=1S/C13H15N3O2/c1-9-8-12(16-15-9)14-13(18)7-6-10-4-2-3-5-11(10)17/h2-5,8,17H,6-7H2,1H3,(H2,14,15,16,18)
InChIKeyNMYKMZYRWJVRKM-UHFFFAOYSA-N
MW245.28 g/mol
LogP2.00
Rot. Bonds4

About 3-(2-hydroxyphenyl)-N-(5-methyl-1H-pyrazol-3-yl)propanamide

3-(2-hydroxyphenyl)-N-(5-methyl-1H-pyrazol-3-yl)propanamide (PubChem CID 47215990) has the molecular formula C13H15N3O2 and a molecular weight of 245.28 g/mol. Its IUPAC name is 3-(2-hydroxyphenyl)-N-(5-methyl-1H-pyrazol-3-yl)propanamide.

Molecular Properties

Compound Name3-(2-hydroxyphenyl)-N-(5-methyl-1H-pyrazol-3-yl)propanamide
PubChem CID47215990
Molecular FormulaC13H15N3O2
Molecular Weight245.28 g/mol
Exact Mass245.12
IUPAC Name3-(2-hydroxyphenyl)-N-(5-methyl-1H-pyrazol-3-yl)propanamide
SMILESCc1cc(NC(=O)CCc2ccccc2O)n[nH]1
InChIInChI=1S/C13H15N3O2/c1-9-8-12(16-15-9)14-13(18)7-6-10-4-2-3-5-11(10)17/h2-5,8,17H,6-7H2,1H3,(H2,14,15,16,18)
InChIKeyNMYKMZYRWJVRKM-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-(2-aminophenyl)-N-(5-methyl-1H-pyrazol-3-yl)propanamide
CID 107273103
3-[2-(aminomethyl)phenyl]-N-(5-methyl-1H-pyrazol-3-yl)propanamide;2,2,2-trifluoroacetic acid
CID 167770709
3-(4-hydroxyphenyl)-N-(5-methyl-1H-pyrazol-3-yl)propanamide
CID 110483845
N-(5-ethyl-1H-pyrazol-3-yl)-2-(2-hydroxyphenyl)acetamide
CID 113229818
3-(4-ethylphenyl)-N-(5-methyl-1H-pyrazol-3-yl)propanamide
CID 47215997
3-(benzenesulfonyl)-N-(5-methyl-1H-pyrazol-3-yl)propanamide
CID 63820393
3-(2-aminophenyl)-N-[5-(2,2-dimethylpropyl)-1H-pyrazol-3-yl]propanamide;hydrochloride
CID 120611017
N-(5-methyl-1H-pyrazol-3-yl)-2-phenoxyacetamide
CID 47148567
N-(5-methyl-1H-pyrazol-3-yl)-3-oxo-3-phenylpropanamide
CID 110463355
3-isoquinolin-5-yl-N-(5-methyl-1H-pyrazol-3-yl)propanamide;2,2,2-trifluoroacetic acid
CID 167836834
1-(5-methyl-1H-pyrazol-3-yl)-3-naphthalen-1-ylurea
CID 3699828
N-(5-methyl-1H-pyrazol-3-yl)nonanamide
CID 47289748

Frequently Asked Questions

What is the IUPAC name of 3-(2-hydroxyphenyl)-N-(5-methyl-1H-pyrazol-3-yl)propanamide?
The IUPAC name of 3-(2-hydroxyphenyl)-N-(5-methyl-1H-pyrazol-3-yl)propanamide (CID 47215990) is 3-(2-hydroxyphenyl)-N-(5-methyl-1H-pyrazol-3-yl)propanamide.
What is the SMILES notation for 3-(2-hydroxyphenyl)-N-(5-methyl-1H-pyrazol-3-yl)propanamide?
The canonical SMILES for 3-(2-hydroxyphenyl)-N-(5-methyl-1H-pyrazol-3-yl)propanamide is Cc1cc(NC(=O)CCc2ccccc2O)n[nH]1.
What is the InChIKey of 3-(2-hydroxyphenyl)-N-(5-methyl-1H-pyrazol-3-yl)propanamide?
The InChIKey is NMYKMZYRWJVRKM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N3O2/c1-9-8-12(16-15-9)14-13(18)7-6-10-4-2-3-5-11(10)17/h2-5,8,17H,6-7H2,1H3,(H2,14,15,16,18).
What are the key properties of 3-(2-hydroxyphenyl)-N-(5-methyl-1H-pyrazol-3-yl)propanamide?
3-(2-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-(2-hydroxyphenyl)-N-(5-methyl-1H-pyrazol-3-yl)propanamide is sourced from PubChem (CID 47215990), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).