3-(2-hydroxy-5-methylphenyl)-3-phenyl-N-propan-2-ylpropanamide

C19H23NO2 — CID 2952978

IUPAC3-(2-hydroxy-5-methylphenyl)-3-phenyl-N-propan-2-ylpropanamide
SMILESCc1ccc(O)c(C(CC(=O)NC(C)C)c2ccccc2)c1
InChIInChI=1S/C19H23NO2/c1-13(2)20-19(22)12-16(15-7-5-4-6-8-15)17-11-14(3)9-10-18(17)21/h4-11,13,16,21H,12H2,1-3H3,(H,20,22)
InChIKeyHBATULHKUYZASV-UHFFFAOYSA-N
MW297.40 g/mol
LogP3.75
Rot. Bonds5

About 3-(2-hydroxy-5-methylphenyl)-3-phenyl-N-propan-2-ylpropanamide

3-(2-hydroxy-5-methylphenyl)-3-phenyl-N-propan-2-ylpropanamide (PubChem CID 2952978) has the molecular formula C19H23NO2 and a molecular weight of 297.40 g/mol. Its IUPAC name is 3-(2-hydroxy-5-methylphenyl)-3-phenyl-N-propan-2-ylpropanamide.

Molecular Properties

Compound Name3-(2-hydroxy-5-methylphenyl)-3-phenyl-N-propan-2-ylpropanamide
PubChem CID2952978
Molecular FormulaC19H23NO2
Molecular Weight297.40 g/mol
Exact Mass297.17
IUPAC Name3-(2-hydroxy-5-methylphenyl)-3-phenyl-N-propan-2-ylpropanamide
SMILESCc1ccc(O)c(C(CC(=O)NC(C)C)c2ccccc2)c1
InChIInChI=1S/C19H23NO2/c1-13(2)20-19(22)12-16(15-7-5-4-6-8-15)17-11-14(3)9-10-18(17)21/h4-11,13,16,21H,12H2,1-3H3,(H,20,22)
InChIKeyHBATULHKUYZASV-UHFFFAOYSA-N
XLogP3.75
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.40
LogP ≤ 53.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N,N'-Hexamethylenebis(3,5-di-tert-butyl-4-hydroxyhydrocinnamamide)
CID 90004
SU 1498
CID 5941539
Tyrosyl alanyl-glycyl-phenylalaninamide
CID 5490373
enkephalinamide-Leu, Ala(2)-
CID 5486816
GM-109
CID 9850904
[Leu5]-Enkephalin, amide
CID 9985128
2,6-Dimethyltyrosyl-N-(3-phenylpropyl)alaninamide
CID 9824220
2-amino-3-(4-hydroxy-2,6-dimethylphenyl)-N-methyl-N-[(2R)-1-oxo-1-(3-phenylpropylamino)propan-2-yl]propanamide
CID 10047255
2-Amino-3-(4-hydroxy-2,6-dimethyl-phenyl)-N-[(R)-1-(3-phenyl-propylcarbamoyl)-ethyl]-propionamide
CID 13656668
3-(2-Hydroxyphenyl)-3-phenyl-1-(piperidin-1-yl)propan-1-one
CID 3149891
N,N'-1,3-Propanediylbis(3,5-di-tert-butyl-4-hydroxyhydrocinnamamide)
CID 112321
Mycocyclosin
CID 59053147

Frequently Asked Questions

What is the IUPAC name of 3-(2-hydroxy-5-methylphenyl)-3-phenyl-N-propan-2-ylpropanamide?
The IUPAC name of 3-(2-hydroxy-5-methylphenyl)-3-phenyl-N-propan-2-ylpropanamide (CID 2952978) is 3-(2-hydroxy-5-methylphenyl)-3-phenyl-N-propan-2-ylpropanamide.
What is the SMILES notation for 3-(2-hydroxy-5-methylphenyl)-3-phenyl-N-propan-2-ylpropanamide?
The canonical SMILES for 3-(2-hydroxy-5-methylphenyl)-3-phenyl-N-propan-2-ylpropanamide is Cc1ccc(O)c(C(CC(=O)NC(C)C)c2ccccc2)c1.
What is the InChIKey of 3-(2-hydroxy-5-methylphenyl)-3-phenyl-N-propan-2-ylpropanamide?
The InChIKey is HBATULHKUYZASV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23NO2/c1-13(2)20-19(22)12-16(15-7-5-4-6-8-15)17-11-14(3)9-10-18(17)21/h4-11,13,16,21H,12H2,1-3H3,(H,20,22).
What are the key properties of 3-(2-hydroxy-5-methylphenyl)-3-phenyl-N-propan-2-ylpropanamide?
3-(2-hydroxy-5-methylphenyl)-3-phenyl-N-propan-2-ylpropanamide has a molecular weight of 297.40 g/mol, XLogP of 3.75, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-hydroxy-5-methylphenyl)-3-phenyl-N-propan-2-ylpropanamide is sourced from PubChem (CID 2952978), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).