N-benzyl-4-hydroxy-N-phenylbutanamide

C17H19NO2 — CID 79191710

IUPACN-benzyl-4-hydroxy-N-phenylbutanamide
SMILESO=C(CCCO)N(Cc1ccccc1)c1ccccc1
InChIInChI=1S/C17H19NO2/c19-13-7-12-17(20)18(16-10-5-2-6-11-16)14-15-8-3-1-4-9-15/h1-6,8-11,19H,7,12-14H2
InChIKeySOILFUVEAXRACS-UHFFFAOYSA-N
MW269.34 g/mol
LogP2.99
Rot. Bonds6

About N-benzyl-4-hydroxy-N-phenylbutanamide

N-benzyl-4-hydroxy-N-phenylbutanamide (PubChem CID 79191710) has the molecular formula C17H19NO2 and a molecular weight of 269.34 g/mol. Its IUPAC name is N-benzyl-4-hydroxy-N-phenylbutanamide.

Molecular Properties

Compound NameN-benzyl-4-hydroxy-N-phenylbutanamide
PubChem CID79191710
Molecular FormulaC17H19NO2
Molecular Weight269.34 g/mol
Exact Mass269.14
IUPAC NameN-benzyl-4-hydroxy-N-phenylbutanamide
SMILESO=C(CCCO)N(Cc1ccccc1)c1ccccc1
InChIInChI=1S/C17H19NO2/c19-13-7-12-17(20)18(16-10-5-2-6-11-16)14-15-8-3-1-4-9-15/h1-6,8-11,19H,7,12-14H2
InChIKeySOILFUVEAXRACS-UHFFFAOYSA-N
XLogP2.99
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.34
LogP ≤ 52.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

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CID 79194764
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CID 79200837
N-benzyl-N-butyl-4-hydroxybutanamide
CID 139706995
2-(2-aminophenyl)-N-benzyl-N-phenylacetamide
CID 28712694
N-benzyl-4-hydroxy-N-(2-methoxyethyl)butanamide
CID 79205106
N-phenyl-4-pyridin-3-yl-N-(pyridin-3-ylmethyl)butanamide
CID 110613065
2-[4-[(N-pentanoylanilino)methyl]phenyl]benzoic acid
CID 159323400
N-benzyl-N-(4-methoxyphenyl)hexanamide
CID 60594646
N-benzyl-3-(3,5-dioxopyrazolidin-4-yl)-N-phenylpropanamide
CID 110703786
N-[3-(N-benzylanilino)-3-oxopropyl]-2,2-dimethylpropanamide
CID 24630749
N-benzyl-3-(cyclopentylamino)-N-phenylpropanamide
CID 109013738

Frequently Asked Questions

What is the IUPAC name of N-benzyl-4-hydroxy-N-phenylbutanamide?
The IUPAC name of N-benzyl-4-hydroxy-N-phenylbutanamide (CID 79191710) is N-benzyl-4-hydroxy-N-phenylbutanamide.
What is the SMILES notation for N-benzyl-4-hydroxy-N-phenylbutanamide?
The canonical SMILES for N-benzyl-4-hydroxy-N-phenylbutanamide is O=C(CCCO)N(Cc1ccccc1)c1ccccc1.
What is the InChIKey of N-benzyl-4-hydroxy-N-phenylbutanamide?
The InChIKey is SOILFUVEAXRACS-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19NO2/c19-13-7-12-17(20)18(16-10-5-2-6-11-16)14-15-8-3-1-4-9-15/h1-6,8-11,19H,7,12-14H2.
What are the key properties of N-benzyl-4-hydroxy-N-phenylbutanamide?
N-benzyl-4-hydroxy-N-phenylbutanamide has a molecular weight of 269.34 g/mol, XLogP of 2.99, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-4-hydroxy-N-phenylbutanamide is sourced from PubChem (CID 79191710), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).