2-hydroxy-N-(2,4,5-trimethylphenyl)propanamide

C12H17NO2 — CID 115140395

IUPAC2-hydroxy-N-(2,4,5-trimethylphenyl)propanamide
SMILESCc1cc(C)c(NC(=O)C(C)O)cc1C
InChIInChI=1S/C12H17NO2/c1-7-5-9(3)11(6-8(7)2)13-12(15)10(4)14/h5-6,10,14H,1-4H3,(H,13,15)
InChIKeyLVFDLLHKXHWPKR-UHFFFAOYSA-N
MW207.27 g/mol
LogP1.93
Rot. Bonds2

About 2-hydroxy-N-(2,4,5-trimethylphenyl)propanamide

2-hydroxy-N-(2,4,5-trimethylphenyl)propanamide (PubChem CID 115140395) has the molecular formula C12H17NO2 and a molecular weight of 207.27 g/mol. Its IUPAC name is 2-hydroxy-N-(2,4,5-trimethylphenyl)propanamide.

Molecular Properties

Compound Name2-hydroxy-N-(2,4,5-trimethylphenyl)propanamide
PubChem CID115140395
Molecular FormulaC12H17NO2
Molecular Weight207.27 g/mol
Exact Mass207.13
IUPAC Name2-hydroxy-N-(2,4,5-trimethylphenyl)propanamide
SMILESCc1cc(C)c(NC(=O)C(C)O)cc1C
InChIInChI=1S/C12H17NO2/c1-7-5-9(3)11(6-8(7)2)13-12(15)10(4)14/h5-6,10,14H,1-4H3,(H,13,15)
InChIKeyLVFDLLHKXHWPKR-UHFFFAOYSA-N
XLogP1.93
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.27
LogP ≤ 51.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-methyl-3-oxo-3-(2,4,5-trimethylanilino)propanoic acid
CID 115164126
N-(5-chloro-4-methoxy-2-methylphenyl)-2-hydroxypropanamide
CID 115140378
2-hydroxy-N-(2,3,5,6-tetramethylphenyl)propanamide
CID 115140366
N-[2,5-dimethyl-4-[(2-methyl-3-oxobutanoyl)amino]phenyl]-2-methyl-3-oxobutanamide
CID 21044969
3-methyl-2-(methylaminomethyl)-N-(2,4,5-trimethylphenyl)butanamide
CID 115187639
N-(2,4,5-trimethylphenyl)carbamoyl fluoride
CID 88834231
1-hydroxy-1-propan-2-yl-3-(2,4,5-trimethylphenyl)urea
CID 19967375
(2R)-2-amino-N-(4,5-dimethoxy-2-methylphenyl)propanamide
CID 54996224
1-(2,2-dimethoxyethyl)-3-(2,4,5-trimethylphenyl)urea
CID 3463712
2-hydroxy-N-(4-methoxy-2,3,6-trimethylphenyl)propanamide
CID 115140443
(2S)-2-amino-N-(2,5-dimethyl-4-nitrophenyl)-3-methylbutanamide
CID 103145485
(2R)-2-hydroxy-N-(2-methyl-4-pyridinyl)propanamide
CID 131207206

Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-N-(2,4,5-trimethylphenyl)propanamide?
The IUPAC name of 2-hydroxy-N-(2,4,5-trimethylphenyl)propanamide (CID 115140395) is 2-hydroxy-N-(2,4,5-trimethylphenyl)propanamide.
What is the SMILES notation for 2-hydroxy-N-(2,4,5-trimethylphenyl)propanamide?
The canonical SMILES for 2-hydroxy-N-(2,4,5-trimethylphenyl)propanamide is Cc1cc(C)c(NC(=O)C(C)O)cc1C.
What is the InChIKey of 2-hydroxy-N-(2,4,5-trimethylphenyl)propanamide?
The InChIKey is LVFDLLHKXHWPKR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17NO2/c1-7-5-9(3)11(6-8(7)2)13-12(15)10(4)14/h5-6,10,14H,1-4H3,(H,13,15).
What are the key properties of 2-hydroxy-N-(2,4,5-trimethylphenyl)propanamide?
2-hydroxy-N-(2,4,5-trimethylphenyl)propanamide has a molecular weight of 207.27 g/mol, XLogP of 1.93, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-N-(2,4,5-trimethylphenyl)propanamide is sourced from PubChem (CID 115140395), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).