N-benzyl-3-hydroxy-3-phenylpropanamide

C16H17NO2 — CID 15473661

IUPACN-benzyl-3-hydroxy-3-phenylpropanamide
SMILESO=C(CC(O)c1ccccc1)NCc1ccccc1
InChIInChI=1S/C16H17NO2/c18-15(14-9-5-2-6-10-14)11-16(19)17-12-13-7-3-1-4-8-13/h1-10,15,18H,11-12H2,(H,17,19)
InChIKeyWAQDPUIIGJPFIZ-UHFFFAOYSA-N
MW255.32 g/mol
LogP2.43
Rot. Bonds5

About N-benzyl-3-hydroxy-3-phenylpropanamide

N-benzyl-3-hydroxy-3-phenylpropanamide (PubChem CID 15473661) has the molecular formula C16H17NO2 and a molecular weight of 255.32 g/mol. Its IUPAC name is N-benzyl-3-hydroxy-3-phenylpropanamide.

Molecular Properties

Compound NameN-benzyl-3-hydroxy-3-phenylpropanamide
PubChem CID15473661
Molecular FormulaC16H17NO2
Molecular Weight255.32 g/mol
Exact Mass255.13
IUPAC NameN-benzyl-3-hydroxy-3-phenylpropanamide
SMILESO=C(CC(O)c1ccccc1)NCc1ccccc1
InChIInChI=1S/C16H17NO2/c18-15(14-9-5-2-6-10-14)11-16(19)17-12-13-7-3-1-4-8-13/h1-10,15,18H,11-12H2,(H,17,19)
InChIKeyWAQDPUIIGJPFIZ-UHFFFAOYSA-N
XLogP2.43
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.32
LogP ≤ 52.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

5-(benzylamino)-5-oxo-3-phenylpentanoic acid
CID 70196436
N-benzyl-3,4-dihydroxybutanamide
CID 69242116
ethane;N-ethyl-3-hydroxy-3-phenylpropanamide
CID 143411629
(3R)-N-benzyl-3-hydroxypentanamide
CID 130658384
(3R)-3-acetamido-N-benzyl-3-hydroxypropanamide
CID 171785861
3,3-diphenyl-N-(pyridin-3-ylmethyl)propanamide
CID 690534
3,4-diamino-N-benzylbutanamide
CID 57016843
N,N'-dibenzyl-2-bromobutanediamide
CID 12947254
3-[2-[(2-hydroxy-2-phenylethyl)amino]-2-oxoethyl]pentanedioic acid
CID 174644675
(2S,3R)-N-benzyl-2,3-dihydroxy-3-phenylpropanamide
CID 71048663
N-[[4-[(dimethylamino)methyl]phenyl]methyl]-3,3-diphenylpropanamide
CID 9194490
3-amino-N-[(4-methylphenyl)methyl]-3-phenylpropanamide
CID 24705411

Frequently Asked Questions

What is the IUPAC name of N-benzyl-3-hydroxy-3-phenylpropanamide?
The IUPAC name of N-benzyl-3-hydroxy-3-phenylpropanamide (CID 15473661) is N-benzyl-3-hydroxy-3-phenylpropanamide.
What is the SMILES notation for N-benzyl-3-hydroxy-3-phenylpropanamide?
The canonical SMILES for N-benzyl-3-hydroxy-3-phenylpropanamide is O=C(CC(O)c1ccccc1)NCc1ccccc1.
What is the InChIKey of N-benzyl-3-hydroxy-3-phenylpropanamide?
The InChIKey is WAQDPUIIGJPFIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17NO2/c18-15(14-9-5-2-6-10-14)11-16(19)17-12-13-7-3-1-4-8-13/h1-10,15,18H,11-12H2,(H,17,19).
What are the key properties of N-benzyl-3-hydroxy-3-phenylpropanamide?
N-benzyl-3-hydroxy-3-phenylpropanamide has a molecular weight of 255.32 g/mol, XLogP of 2.43, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-3-hydroxy-3-phenylpropanamide is sourced from PubChem (CID 15473661), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).