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

C12H13N3O2 — CID 110483844

IUPAC3-(4-hydroxyphenyl)-N-(1H-pyrazol-5-yl)propanamide
SMILESO=C(CCc1ccc(O)cc1)Nc1ccn[nH]1
InChIInChI=1S/C12H13N3O2/c16-10-4-1-9(2-5-10)3-6-12(17)14-11-7-8-13-15-11/h1-2,4-5,7-8,16H,3,6H2,(H2,13,14,15,17)
InChIKeyOGPJBSDREJNPOK-UHFFFAOYSA-N
MW231.26 g/mol
LogP1.69
Rot. Bonds4

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

3-(4-hydroxyphenyl)-N-(1H-pyrazol-5-yl)propanamide (PubChem CID 110483844) has the molecular formula C12H13N3O2 and a molecular weight of 231.26 g/mol. Its IUPAC name is 3-(4-hydroxyphenyl)-N-(1H-pyrazol-5-yl)propanamide.

Molecular Properties

Compound Name3-(4-hydroxyphenyl)-N-(1H-pyrazol-5-yl)propanamide
PubChem CID110483844
Molecular FormulaC12H13N3O2
Molecular Weight231.26 g/mol
Exact Mass231.10
IUPAC Name3-(4-hydroxyphenyl)-N-(1H-pyrazol-5-yl)propanamide
SMILESO=C(CCc1ccc(O)cc1)Nc1ccn[nH]1
InChIInChI=1S/C12H13N3O2/c16-10-4-1-9(2-5-10)3-6-12(17)14-11-7-8-13-15-11/h1-2,4-5,7-8,16H,3,6H2,(H2,13,14,15,17)
InChIKeyOGPJBSDREJNPOK-UHFFFAOYSA-N
XLogP1.69
TPSA78.01 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.26
LogP ≤ 51.69
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

3-(ethylamino)-N-(1H-pyrazol-5-yl)propanamide
CID 62834246
3-methylsulfinyl-N-(1H-pyrazol-5-yl)propanamide
CID 130652327
3-acetamido-N-(1H-pyrazol-5-yl)propanamide
CID 61393399
3-(4-hydroxyphenyl)-N-(5-methyl-1H-pyrazol-3-yl)propanamide
CID 110483845
3-(tert-butylamino)-N-(1H-pyrazol-5-yl)propanamide
CID 61394138
4-(chloromethyl)-N-(1H-pyrazol-5-yl)benzamide
CID 61394435
2-methylsulfanyl-N-(1H-pyrazol-5-yl)acetamide
CID 61393731
3-phenylsulfanyl-N-(1H-pyrazol-5-yl)propanamide
CID 61393999
2-[2-oxo-2-(1H-pyrazol-5-ylamino)ethoxy]acetic acid
CID 61393398
N-(4-hydroxyphenyl)-3-phenylpropanamide
CID 836055
[3-(4-hydroxyphenyl)propanoylamino]thiourea
CID 89489494
3-(4-methylphenoxy)-N-(1H-pyrazol-5-yl)propanamide
CID 61393951

Frequently Asked Questions

What is the IUPAC name of 3-(4-hydroxyphenyl)-N-(1H-pyrazol-5-yl)propanamide?
The IUPAC name of 3-(4-hydroxyphenyl)-N-(1H-pyrazol-5-yl)propanamide (CID 110483844) is 3-(4-hydroxyphenyl)-N-(1H-pyrazol-5-yl)propanamide.
What is the SMILES notation for 3-(4-hydroxyphenyl)-N-(1H-pyrazol-5-yl)propanamide?
The canonical SMILES for 3-(4-hydroxyphenyl)-N-(1H-pyrazol-5-yl)propanamide is O=C(CCc1ccc(O)cc1)Nc1ccn[nH]1.
What is the InChIKey of 3-(4-hydroxyphenyl)-N-(1H-pyrazol-5-yl)propanamide?
The InChIKey is OGPJBSDREJNPOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13N3O2/c16-10-4-1-9(2-5-10)3-6-12(17)14-11-7-8-13-15-11/h1-2,4-5,7-8,16H,3,6H2,(H2,13,14,15,17).
What are the key properties of 3-(4-hydroxyphenyl)-N-(1H-pyrazol-5-yl)propanamide?
3-(4-hydroxyphenyl)-N-(1H-pyrazol-5-yl)propanamide has a molecular weight of 231.26 g/mol, XLogP of 1.69, 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-(1H-pyrazol-5-yl)propanamide is sourced from PubChem (CID 110483844), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).