N-(2-hydroxyethyl)-N-(2-phenylethyl)butanamide

C14H21NO2 — CID 111122043

IUPACN-(2-hydroxyethyl)-N-(2-phenylethyl)butanamide
SMILESCCCC(=O)N(CCO)CCc1ccccc1
InChIInChI=1S/C14H21NO2/c1-2-6-14(17)15(11-12-16)10-9-13-7-4-3-5-8-13/h3-5,7-8,16H,2,6,9-12H2,1H3
InChIKeyCERZWGYKXUXJPC-UHFFFAOYSA-N
MW235.33 g/mol
LogP1.85
Rot. Bonds7

About N-(2-hydroxyethyl)-N-(2-phenylethyl)butanamide

N-(2-hydroxyethyl)-N-(2-phenylethyl)butanamide (PubChem CID 111122043) has the molecular formula C14H21NO2 and a molecular weight of 235.33 g/mol. Its IUPAC name is N-(2-hydroxyethyl)-N-(2-phenylethyl)butanamide.

Molecular Properties

Compound NameN-(2-hydroxyethyl)-N-(2-phenylethyl)butanamide
PubChem CID111122043
Molecular FormulaC14H21NO2
Molecular Weight235.33 g/mol
Exact Mass235.16
IUPAC NameN-(2-hydroxyethyl)-N-(2-phenylethyl)butanamide
SMILESCCCC(=O)N(CCO)CCc1ccccc1
InChIInChI=1S/C14H21NO2/c1-2-6-14(17)15(11-12-16)10-9-13-7-4-3-5-8-13/h3-5,7-8,16H,2,6,9-12H2,1H3
InChIKeyCERZWGYKXUXJPC-UHFFFAOYSA-N
XLogP1.85
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.33
LogP ≤ 51.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-[butanoyl(2-phenylethyl)amino]propanoic acid
CID 82323377
N-[4-[2-[butanoyl(2-hydroxyethyl)amino]ethyl]phenyl]butanamide
CID 122140471
N,N-bis(2-hydroxyethyl)butanamide
CID 14455174
N-benzyl-N-(2-phenylethyl)pentanamide
CID 112791262
N',N'-bis(2-phenylethyl)butanediamide
CID 70184693
N,N-dihexyl-3-phenylpropanamide
CID 532921
N-(2-hydroxyethyl)-2-methyl-N-(2-phenylethyl)benzamide
CID 111122128
2-[acetyl(2-phenylethyl)amino]-N,N-dipropylacetamide
CID 113164026
N-ethyl-N-(3-hydroxypropyl)-4-phenylbutanamide
CID 115772082
N-(2-hydroxyethyl)-3-(4-methylphenyl)-N-propylpropanamide
CID 60702090
5-[ethyl(2-phenylethyl)amino]-5-oxopentanoic acid
CID 54875421
N-(2-aminoethyl)-3-phenyl-N-propylpropanamide
CID 61348391

Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxyethyl)-N-(2-phenylethyl)butanamide?
The IUPAC name of N-(2-hydroxyethyl)-N-(2-phenylethyl)butanamide (CID 111122043) is N-(2-hydroxyethyl)-N-(2-phenylethyl)butanamide.
What is the SMILES notation for N-(2-hydroxyethyl)-N-(2-phenylethyl)butanamide?
The canonical SMILES for N-(2-hydroxyethyl)-N-(2-phenylethyl)butanamide is CCCC(=O)N(CCO)CCc1ccccc1.
What is the InChIKey of N-(2-hydroxyethyl)-N-(2-phenylethyl)butanamide?
The InChIKey is CERZWGYKXUXJPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO2/c1-2-6-14(17)15(11-12-16)10-9-13-7-4-3-5-8-13/h3-5,7-8,16H,2,6,9-12H2,1H3.
What are the key properties of N-(2-hydroxyethyl)-N-(2-phenylethyl)butanamide?
N-(2-hydroxyethyl)-N-(2-phenylethyl)butanamide has a molecular weight of 235.33 g/mol, XLogP of 1.85, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxyethyl)-N-(2-phenylethyl)butanamide is sourced from PubChem (CID 111122043), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).