2-hydroxy-N-[2-(2,4,6-trimethylphenyl)ethyl]propanamide

C14H21NO2 — CID 115140912

IUPAC2-hydroxy-N-[2-(2,4,6-trimethylphenyl)ethyl]propanamide
SMILESCc1cc(C)c(CCNC(=O)C(C)O)c(C)c1
InChIInChI=1S/C14H21NO2/c1-9-7-10(2)13(11(3)8-9)5-6-15-14(17)12(4)16/h7-8,12,16H,5-6H2,1-4H3,(H,15,17)
InChIKeyHOCUGYNOIOPMCU-UHFFFAOYSA-N
MW235.33 g/mol
LogP1.65
Rot. Bonds4

About 2-hydroxy-N-[2-(2,4,6-trimethylphenyl)ethyl]propanamide

2-hydroxy-N-[2-(2,4,6-trimethylphenyl)ethyl]propanamide (PubChem CID 115140912) has the molecular formula C14H21NO2 and a molecular weight of 235.33 g/mol. Its IUPAC name is 2-hydroxy-N-[2-(2,4,6-trimethylphenyl)ethyl]propanamide.

Molecular Properties

Compound Name2-hydroxy-N-[2-(2,4,6-trimethylphenyl)ethyl]propanamide
PubChem CID115140912
Molecular FormulaC14H21NO2
Molecular Weight235.33 g/mol
Exact Mass235.16
IUPAC Name2-hydroxy-N-[2-(2,4,6-trimethylphenyl)ethyl]propanamide
SMILESCc1cc(C)c(CCNC(=O)C(C)O)c(C)c1
InChIInChI=1S/C14H21NO2/c1-9-7-10(2)13(11(3)8-9)5-6-15-14(17)12(4)16/h7-8,12,16H,5-6H2,1-4H3,(H,15,17)
InChIKeyHOCUGYNOIOPMCU-UHFFFAOYSA-N
XLogP1.65
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.33
LogP ≤ 51.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

(2R)-2-amino-N-[2-(2,4,6-trimethylphenyl)ethyl]propanamide
CID 94686299
(2R)-2-amino-N-[2-(2,4,6-trimethylphenyl)ethyl]propanamide;hydrochloride
CID 119288877
2-methyl-3-oxo-3-[2-(2,4,6-trimethylphenyl)ethylamino]propanoic acid
CID 115164343
(2S)-2-amino-3-methyl-N-[2-(2,4,6-trimethylphenyl)ethyl]butanamide
CID 94693681
N-[2-(2,4,6-trimethylphenyl)ethyl]acetamide
CID 110788028
2-(propan-2-ylamino)-N-[2-(2,4,6-trimethylphenyl)ethyl]acetamide
CID 115158305
3-sulfanyl-N-[2-(2,4,6-trimethylphenyl)ethyl]propanamide
CID 115168005
N-[2-(2,4,6-trimethylphenyl)ethyl]propan-2-amine
CID 62549698
2-[4-(1-hydroxyethyl)piperidin-1-yl]-N-[2-(2,4,6-trimethylphenyl)ethyl]acetamide
CID 111114173
2-(2-methoxy-4,6-dimethylphenyl)ethylcarbamic acid
CID 115171165
1-cyano-N-[2-(2,4,6-trimethylphenyl)ethyl]cyclopropane-1-carboxamide
CID 115181683
N-propyl-2-[(2,4,6-trimethylphenyl)methylamino]propanamide
CID 43221777

Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-N-[2-(2,4,6-trimethylphenyl)ethyl]propanamide?
The IUPAC name of 2-hydroxy-N-[2-(2,4,6-trimethylphenyl)ethyl]propanamide (CID 115140912) is 2-hydroxy-N-[2-(2,4,6-trimethylphenyl)ethyl]propanamide.
What is the SMILES notation for 2-hydroxy-N-[2-(2,4,6-trimethylphenyl)ethyl]propanamide?
The canonical SMILES for 2-hydroxy-N-[2-(2,4,6-trimethylphenyl)ethyl]propanamide is Cc1cc(C)c(CCNC(=O)C(C)O)c(C)c1.
What is the InChIKey of 2-hydroxy-N-[2-(2,4,6-trimethylphenyl)ethyl]propanamide?
The InChIKey is HOCUGYNOIOPMCU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO2/c1-9-7-10(2)13(11(3)8-9)5-6-15-14(17)12(4)16/h7-8,12,16H,5-6H2,1-4H3,(H,15,17).
What are the key properties of 2-hydroxy-N-[2-(2,4,6-trimethylphenyl)ethyl]propanamide?
2-hydroxy-N-[2-(2,4,6-trimethylphenyl)ethyl]propanamide has a molecular weight of 235.33 g/mol, XLogP of 1.65, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-N-[2-(2,4,6-trimethylphenyl)ethyl]propanamide is sourced from PubChem (CID 115140912), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).