4-[benzyl(2-phenylethyl)amino]-N-hydroxybutanamide

C19H24N2O2 — CID 155156496

IUPAC4-[benzyl(2-phenylethyl)amino]-N-hydroxybutanamide
SMILESO=C(CCCN(CCc1ccccc1)Cc1ccccc1)NO
InChIInChI=1S/C19H24N2O2/c22-19(20-23)12-7-14-21(16-18-10-5-2-6-11-18)15-13-17-8-3-1-4-9-17/h1-6,8-11,23H,7,12-16H2,(H,20,22)
InChIKeyXMPOWJSNDQWSLG-UHFFFAOYSA-N
MW312.41 g/mol
LogP3.02
Rot. Bonds9

About 4-[benzyl(2-phenylethyl)amino]-N-hydroxybutanamide

4-[benzyl(2-phenylethyl)amino]-N-hydroxybutanamide (PubChem CID 155156496) has the molecular formula C19H24N2O2 and a molecular weight of 312.41 g/mol. Its IUPAC name is 4-[benzyl(2-phenylethyl)amino]-N-hydroxybutanamide.

Molecular Properties

Compound Name4-[benzyl(2-phenylethyl)amino]-N-hydroxybutanamide
PubChem CID155156496
Molecular FormulaC19H24N2O2
Molecular Weight312.41 g/mol
Exact Mass312.18
IUPAC Name4-[benzyl(2-phenylethyl)amino]-N-hydroxybutanamide
SMILESO=C(CCCN(CCc1ccccc1)Cc1ccccc1)NO
InChIInChI=1S/C19H24N2O2/c22-19(20-23)12-7-14-21(16-18-10-5-2-6-11-18)15-13-17-8-3-1-4-9-17/h1-6,8-11,23H,7,12-16H2,(H,20,22)
InChIKeyXMPOWJSNDQWSLG-UHFFFAOYSA-N
XLogP3.02
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.41
LogP ≤ 53.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydroxamic_acid', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

4-(dibenzylamino)butanehydrazide
CID 130159101
N-[[4-[[bis(2-phenylethyl)amino]methyl]phenyl]methyl]-2-phenyl-N-(2-phenylethyl)ethanamine
CID 59482591
benzene;formic acid;N-hydroxy-3-phenylpropanamide
CID 174900807
N-hydroxy-3-[4-(2-phenylethyl)phenyl]propanamide
CID 22986796
N-hydroxy-6-phenylhexanamide;thiohydroxylamine
CID 142086803
N,N-dibenzyl-3-phenylpropan-1-amine
CID 3867567
4-[benzyl(2,2-difluoroethyl)amino]butanoic acid
CID 119145583
3-[3-(dimethylamino)propyl-(2-phenylethyl)amino]propanoic acid
CID 82330379
azane;3-(dibenzylamino)propanoic acid
CID 162310692
2-[benzyl(4-phenylbutyl)amino]ethanol
CID 114334509
3-[benzyl(2-hydroxyethyl)amino]propanoic acid
CID 43841843
(E)-3-[4-[[ethyl(3-phenylpropyl)amino]methyl]phenyl]-N-hydroxyprop-2-enamide
CID 20579472

Frequently Asked Questions

What is the IUPAC name of 4-[benzyl(2-phenylethyl)amino]-N-hydroxybutanamide?
The IUPAC name of 4-[benzyl(2-phenylethyl)amino]-N-hydroxybutanamide (CID 155156496) is 4-[benzyl(2-phenylethyl)amino]-N-hydroxybutanamide.
What is the SMILES notation for 4-[benzyl(2-phenylethyl)amino]-N-hydroxybutanamide?
The canonical SMILES for 4-[benzyl(2-phenylethyl)amino]-N-hydroxybutanamide is O=C(CCCN(CCc1ccccc1)Cc1ccccc1)NO.
What is the InChIKey of 4-[benzyl(2-phenylethyl)amino]-N-hydroxybutanamide?
The InChIKey is XMPOWJSNDQWSLG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O2/c22-19(20-23)12-7-14-21(16-18-10-5-2-6-11-18)15-13-17-8-3-1-4-9-17/h1-6,8-11,23H,7,12-16H2,(H,20,22).
What are the key properties of 4-[benzyl(2-phenylethyl)amino]-N-hydroxybutanamide?
4-[benzyl(2-phenylethyl)amino]-N-hydroxybutanamide has a molecular weight of 312.41 g/mol, XLogP of 3.02, 9 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[benzyl(2-phenylethyl)amino]-N-hydroxybutanamide is sourced from PubChem (CID 155156496), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).