3-amino-N-(2-ethyl-2-hydroxybutyl)-2-phenylpropanamide

C15H24N2O2 — CID 65106734

IUPAC3-amino-N-(2-ethyl-2-hydroxybutyl)-2-phenylpropanamide
SMILESCCC(O)(CC)CNC(=O)C(CN)c1ccccc1
InChIInChI=1S/C15H24N2O2/c1-3-15(19,4-2)11-17-14(18)13(10-16)12-8-6-5-7-9-12/h5-9,13,19H,3-4,10-11,16H2,1-2H3,(H,17,18)
InChIKeyZZLBOSGQUOHUPV-UHFFFAOYSA-N
MW264.37 g/mol
LogP1.40
Rot. Bonds7

About 3-amino-N-(2-ethyl-2-hydroxybutyl)-2-phenylpropanamide

3-amino-N-(2-ethyl-2-hydroxybutyl)-2-phenylpropanamide (PubChem CID 65106734) has the molecular formula C15H24N2O2 and a molecular weight of 264.37 g/mol. Its IUPAC name is 3-amino-N-(2-ethyl-2-hydroxybutyl)-2-phenylpropanamide.

Molecular Properties

Compound Name3-amino-N-(2-ethyl-2-hydroxybutyl)-2-phenylpropanamide
PubChem CID65106734
Molecular FormulaC15H24N2O2
Molecular Weight264.37 g/mol
Exact Mass264.18
IUPAC Name3-amino-N-(2-ethyl-2-hydroxybutyl)-2-phenylpropanamide
SMILESCCC(O)(CC)CNC(=O)C(CN)c1ccccc1
InChIInChI=1S/C15H24N2O2/c1-3-15(19,4-2)11-17-14(18)13(10-16)12-8-6-5-7-9-12/h5-9,13,19H,3-4,10-11,16H2,1-2H3,(H,17,18)
InChIKeyZZLBOSGQUOHUPV-UHFFFAOYSA-N
XLogP1.40
TPSA75.35 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 51.40
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

3-amino-N-(2-hydroxy-2-methylbutyl)-2-phenylpropanamide
CID 65106056
3-amino-N-(2-ethyl-2-methylsulfanylbutyl)-2-phenylpropanamide
CID 103812535
3-amino-N-(2-hydroxy-2,4-dimethylpentyl)-2-phenylpropanamide
CID 66174479
3-amino-N-(2-methyl-2-phenylpropyl)-2-phenylpropanamide;hydrochloride
CID 119724299
3-amino-2-phenyl-N-(2-phenylethyl)propanamide
CID 62879042
2-[[(3-amino-2-phenylpropanoyl)amino]methyl]-3-methylbutanoic acid
CID 65224383
2-[[(3-amino-2-phenylpropanoyl)amino]methyl]butanoic acid
CID 65224288
3-amino-N-(2-methyl-2-thiophen-2-ylpropyl)-2-phenylpropanamide
CID 80526634
3-amino-N-[2-(4-hydroxyphenyl)ethyl]-2-phenylpropanamide
CID 62878017
3-amino-N-(2-hydroxy-3-methylbutyl)-2-phenylpropanamide
CID 113492233
5-[(3-amino-2-phenylpropanoyl)amino]pentanamide
CID 106235045
2-[(3-amino-2-phenylpropanoyl)amino]-2-methylpentanoic acid
CID 62878367

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-(2-ethyl-2-hydroxybutyl)-2-phenylpropanamide?
The IUPAC name of 3-amino-N-(2-ethyl-2-hydroxybutyl)-2-phenylpropanamide (CID 65106734) is 3-amino-N-(2-ethyl-2-hydroxybutyl)-2-phenylpropanamide.
What is the SMILES notation for 3-amino-N-(2-ethyl-2-hydroxybutyl)-2-phenylpropanamide?
The canonical SMILES for 3-amino-N-(2-ethyl-2-hydroxybutyl)-2-phenylpropanamide is CCC(O)(CC)CNC(=O)C(CN)c1ccccc1.
What is the InChIKey of 3-amino-N-(2-ethyl-2-hydroxybutyl)-2-phenylpropanamide?
The InChIKey is ZZLBOSGQUOHUPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O2/c1-3-15(19,4-2)11-17-14(18)13(10-16)12-8-6-5-7-9-12/h5-9,13,19H,3-4,10-11,16H2,1-2H3,(H,17,18).
What are the key properties of 3-amino-N-(2-ethyl-2-hydroxybutyl)-2-phenylpropanamide?
3-amino-N-(2-ethyl-2-hydroxybutyl)-2-phenylpropanamide has a molecular weight of 264.37 g/mol, XLogP of 1.40, 7 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-(2-ethyl-2-hydroxybutyl)-2-phenylpropanamide is sourced from PubChem (CID 65106734), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).