3-(4-ethylphenyl)-N-(2-hydroxy-2-pyridin-4-ylethyl)propanamide

C18H22N2O2 — CID 71911698

IUPAC3-(4-ethylphenyl)-N-(2-hydroxy-2-pyridin-4-ylethyl)propanamide
SMILESCCc1ccc(CCC(=O)NCC(O)c2ccncc2)cc1
InChIInChI=1S/C18H22N2O2/c1-2-14-3-5-15(6-4-14)7-8-18(22)20-13-17(21)16-9-11-19-12-10-16/h3-6,9-12,17,21H,2,7-8,13H2,1H3,(H,20,22)
InChIKeyASUJTQDMPNGDFC-UHFFFAOYSA-N
MW298.39 g/mol
LogP2.43
Rot. Bonds7

About 3-(4-ethylphenyl)-N-(2-hydroxy-2-pyridin-4-ylethyl)propanamide

3-(4-ethylphenyl)-N-(2-hydroxy-2-pyridin-4-ylethyl)propanamide (PubChem CID 71911698) has the molecular formula C18H22N2O2 and a molecular weight of 298.39 g/mol. Its IUPAC name is 3-(4-ethylphenyl)-N-(2-hydroxy-2-pyridin-4-ylethyl)propanamide.

Molecular Properties

Compound Name3-(4-ethylphenyl)-N-(2-hydroxy-2-pyridin-4-ylethyl)propanamide
PubChem CID71911698
Molecular FormulaC18H22N2O2
Molecular Weight298.39 g/mol
Exact Mass298.17
IUPAC Name3-(4-ethylphenyl)-N-(2-hydroxy-2-pyridin-4-ylethyl)propanamide
SMILESCCc1ccc(CCC(=O)NCC(O)c2ccncc2)cc1
InChIInChI=1S/C18H22N2O2/c1-2-14-3-5-15(6-4-14)7-8-18(22)20-13-17(21)16-9-11-19-12-10-16/h3-6,9-12,17,21H,2,7-8,13H2,1H3,(H,20,22)
InChIKeyASUJTQDMPNGDFC-UHFFFAOYSA-N
XLogP2.43
TPSA62.22 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.39
LogP ≤ 52.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-(4-ethylphenyl)-N-[2-(4-fluorophenyl)-2-hydroxyethyl]propanamide
CID 110888819
N-[(2S)-2-hydroxy-2-phenylethyl]-3-phenylpropanamide
CID 93032888
methyl 3-[3-(4-ethylphenyl)propanoylamino]-2-hydroxypropanoate
CID 103879309
3-(4-aminophenyl)-N-(2-hydroxy-2-phenylethyl)propanamide
CID 61036910
2-[[3-(4-ethylphenyl)propanoylamino]methyl]pentanoic acid
CID 65219639
N-[2-(2-hydroxyethyl)pentyl]-3-pyridin-4-ylpropanamide
CID 103722641
4-(3-hydroxy-3-methylbutyl)-N-[(2R)-2-hydroxy-2-pyridin-4-ylethyl]benzamide
CID 95897248
N-[2-(2-hydroxypropylamino)ethyl]-3-pyridin-4-ylpropanamide
CID 104593486
tert-butyl N-[(2R)-2-hydroxy-2-pyridin-4-ylethyl]carbamate
CID 129375181
N-(3-amino-2,2-dimethylpropyl)-3-(4-ethylphenyl)propanamide
CID 115271070
2-[4-(4-hydroxy-4-pyridin-4-ylbutyl)phenyl]-N-methylacetamide
CID 59745003
N-[(2R)-2-hydroxypropyl]-3-(4-methylphenyl)propanamide
CID 83032441

Frequently Asked Questions

What is the IUPAC name of 3-(4-ethylphenyl)-N-(2-hydroxy-2-pyridin-4-ylethyl)propanamide?
The IUPAC name of 3-(4-ethylphenyl)-N-(2-hydroxy-2-pyridin-4-ylethyl)propanamide (CID 71911698) is 3-(4-ethylphenyl)-N-(2-hydroxy-2-pyridin-4-ylethyl)propanamide.
What is the SMILES notation for 3-(4-ethylphenyl)-N-(2-hydroxy-2-pyridin-4-ylethyl)propanamide?
The canonical SMILES for 3-(4-ethylphenyl)-N-(2-hydroxy-2-pyridin-4-ylethyl)propanamide is CCc1ccc(CCC(=O)NCC(O)c2ccncc2)cc1.
What is the InChIKey of 3-(4-ethylphenyl)-N-(2-hydroxy-2-pyridin-4-ylethyl)propanamide?
The InChIKey is ASUJTQDMPNGDFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N2O2/c1-2-14-3-5-15(6-4-14)7-8-18(22)20-13-17(21)16-9-11-19-12-10-16/h3-6,9-12,17,21H,2,7-8,13H2,1H3,(H,20,22).
What are the key properties of 3-(4-ethylphenyl)-N-(2-hydroxy-2-pyridin-4-ylethyl)propanamide?
3-(4-ethylphenyl)-N-(2-hydroxy-2-pyridin-4-ylethyl)propanamide has a molecular weight of 298.39 g/mol, XLogP of 2.43, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-ethylphenyl)-N-(2-hydroxy-2-pyridin-4-ylethyl)propanamide is sourced from PubChem (CID 71911698), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).