N-[1-(4-hydroxyphenyl)ethyl]-N-methyl-2-pyrazol-1-ylpropanamide

C15H19N3O2 — CID 61043232

IUPACN-[1-(4-hydroxyphenyl)ethyl]-N-methyl-2-pyrazol-1-ylpropanamide
SMILESCC(c1ccc(O)cc1)N(C)C(=O)C(C)n1cccn1
InChIInChI=1S/C15H19N3O2/c1-11(13-5-7-14(19)8-6-13)17(3)15(20)12(2)18-10-4-9-16-18/h4-12,19H,1-3H3
InChIKeyDKPQJEKADGLUAI-UHFFFAOYSA-N
MW273.34 g/mol
LogP2.37
Rot. Bonds4

About N-[1-(4-hydroxyphenyl)ethyl]-N-methyl-2-pyrazol-1-ylpropanamide

N-[1-(4-hydroxyphenyl)ethyl]-N-methyl-2-pyrazol-1-ylpropanamide (PubChem CID 61043232) has the molecular formula C15H19N3O2 and a molecular weight of 273.34 g/mol. Its IUPAC name is N-[1-(4-hydroxyphenyl)ethyl]-N-methyl-2-pyrazol-1-ylpropanamide.

Molecular Properties

Compound NameN-[1-(4-hydroxyphenyl)ethyl]-N-methyl-2-pyrazol-1-ylpropanamide
PubChem CID61043232
Molecular FormulaC15H19N3O2
Molecular Weight273.34 g/mol
Exact Mass273.15
IUPAC NameN-[1-(4-hydroxyphenyl)ethyl]-N-methyl-2-pyrazol-1-ylpropanamide
SMILESCC(c1ccc(O)cc1)N(C)C(=O)C(C)n1cccn1
InChIInChI=1S/C15H19N3O2/c1-11(13-5-7-14(19)8-6-13)17(3)15(20)12(2)18-10-4-9-16-18/h4-12,19H,1-3H3
InChIKeyDKPQJEKADGLUAI-UHFFFAOYSA-N
XLogP2.37
TPSA58.36 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.34
LogP ≤ 52.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(2R)-N-[(R)-(4-fluorophenyl)-phenylmethyl]-N-methyl-2-pyrazol-1-ylpropanamide
CID 95934298
3-[methyl(2-pyrazol-1-ylpropanoyl)amino]propanoic acid
CID 60988614
N-[(5-chlorothiophen-2-yl)methyl]-N-methyl-2-pyrazol-1-ylpropanamide
CID 134048451
N-[1-(4-hydroxyphenyl)ethyl]-N,1-dimethylpyrazole-4-carboxamide
CID 54913256
(2S)-N-[2-(2-fluoro-N-methylanilino)-2-oxoethyl]-N-methyl-2-pyrazol-1-ylpropanamide
CID 95335128
N-ethyl-N-(4-fluorophenyl)-2-pyrazol-1-ylpropanamide
CID 134048647
N-(3,3-diphenylpropyl)-2-pyrazol-1-ylpropanamide
CID 134060458
N-[1-(4-hydroxyphenyl)ethyl]-N,6-dimethylpyridine-2-carboxamide
CID 61043579
(2S)-2-pyrazol-1-ylpropanamide
CID 42576360
2-pyrazol-1-ylpropanamide
CID 25248322
(2R)-N-methyl-N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)ethyl]-2-pyrazol-1-ylpropanamide
CID 125142916
3-hydroxy-N-[1-(4-hydroxyphenyl)ethyl]-N-methylbenzamide
CID 61044546

Frequently Asked Questions

What is the IUPAC name of N-[1-(4-hydroxyphenyl)ethyl]-N-methyl-2-pyrazol-1-ylpropanamide?
The IUPAC name of N-[1-(4-hydroxyphenyl)ethyl]-N-methyl-2-pyrazol-1-ylpropanamide (CID 61043232) is N-[1-(4-hydroxyphenyl)ethyl]-N-methyl-2-pyrazol-1-ylpropanamide.
What is the SMILES notation for N-[1-(4-hydroxyphenyl)ethyl]-N-methyl-2-pyrazol-1-ylpropanamide?
The canonical SMILES for N-[1-(4-hydroxyphenyl)ethyl]-N-methyl-2-pyrazol-1-ylpropanamide is CC(c1ccc(O)cc1)N(C)C(=O)C(C)n1cccn1.
What is the InChIKey of N-[1-(4-hydroxyphenyl)ethyl]-N-methyl-2-pyrazol-1-ylpropanamide?
The InChIKey is DKPQJEKADGLUAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O2/c1-11(13-5-7-14(19)8-6-13)17(3)15(20)12(2)18-10-4-9-16-18/h4-12,19H,1-3H3.
What are the key properties of N-[1-(4-hydroxyphenyl)ethyl]-N-methyl-2-pyrazol-1-ylpropanamide?
N-[1-(4-hydroxyphenyl)ethyl]-N-methyl-2-pyrazol-1-ylpropanamide has a molecular weight of 273.34 g/mol, XLogP of 2.37, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(4-hydroxyphenyl)ethyl]-N-methyl-2-pyrazol-1-ylpropanamide is sourced from PubChem (CID 61043232), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).