N-[(1S,2R)-2-hydroxy-1-phenylpropyl]benzamide

C16H17NO2 — CID 6934600

IUPACN-[(1S,2R)-2-hydroxy-1-phenylpropyl]benzamide
SMILESC[C@@H](O)[C@@H](NC(=O)c1ccccc1)c1ccccc1
InChIInChI=1S/C16H17NO2/c1-12(18)15(13-8-4-2-5-9-13)17-16(19)14-10-6-3-7-11-14/h2-12,15,18H,1H3,(H,17,19)/t12-,15-/m1/s1
InChIKeyLNPDNDIGGRBFTO-IUODEOHRSA-N
MW255.32 g/mol
LogP2.54
Rot. Bonds4

About N-[(1S,2R)-2-hydroxy-1-phenylpropyl]benzamide

N-[(1S,2R)-2-hydroxy-1-phenylpropyl]benzamide (PubChem CID 6934600) has the molecular formula C16H17NO2 and a molecular weight of 255.32 g/mol. Its IUPAC name is N-[(1S,2R)-2-hydroxy-1-phenylpropyl]benzamide.

Molecular Properties

Compound NameN-[(1S,2R)-2-hydroxy-1-phenylpropyl]benzamide
PubChem CID6934600
Molecular FormulaC16H17NO2
Molecular Weight255.32 g/mol
Exact Mass255.13
IUPAC NameN-[(1S,2R)-2-hydroxy-1-phenylpropyl]benzamide
SMILESC[C@@H](O)[C@@H](NC(=O)c1ccccc1)c1ccccc1
InChIInChI=1S/C16H17NO2/c1-12(18)15(13-8-4-2-5-9-13)17-16(19)14-10-6-3-7-11-14/h2-12,15,18H,1H3,(H,17,19)/t12-,15-/m1/s1
InChIKeyLNPDNDIGGRBFTO-IUODEOHRSA-N
XLogP2.54
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.32
LogP ≤ 52.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(1R,2S,3R)-3-hydroxy-2-methyl-1,3-diphenylpropyl]benzamide
CID 134903315
N-(2-hydroxy-3-oxo-1-phenylbutyl)benzamide
CID 71218694
3-benzamido-2-hydroxy-3-phenylpropanoic acid;hydrochloride
CID 175045736
N-[(1R)-2-acetyl-3-oxo-1-phenylbutyl]benzamide
CID 11587624
N-(2,3-dihydroxy-1-phenylpropyl)benzamide
CID 14650575
(2S,3R)-3-benzamido-2-hydroxy-3-phenylpropanethioic S-acid
CID 18660976
N-[(1S,2R)-2-hydroxy-1-phenylbut-3-enyl]benzamide
CID 57161994
4-methyl-N-[(1S)-2-methyl-1-phenylpropyl]benzamide
CID 9050629
N-[(1S)-2-methyl-1-phenylpropyl]-4-phenylbenzamide
CID 6594177
(2S)-2-benzamido-3-phenylbutanoic acid
CID 18652423
4-chloro-N-[(1S)-2-methyl-1-phenylpropyl]benzamide
CID 9050596
(2R,3S)-3-benzamido-3-phenyl-2-phosphanyloxypropanoic acid
CID 71168164

Frequently Asked Questions

What is the IUPAC name of N-[(1S,2R)-2-hydroxy-1-phenylpropyl]benzamide?
The IUPAC name of N-[(1S,2R)-2-hydroxy-1-phenylpropyl]benzamide (CID 6934600) is N-[(1S,2R)-2-hydroxy-1-phenylpropyl]benzamide.
What is the SMILES notation for N-[(1S,2R)-2-hydroxy-1-phenylpropyl]benzamide?
The canonical SMILES for N-[(1S,2R)-2-hydroxy-1-phenylpropyl]benzamide is C[C@@H](O)[C@@H](NC(=O)c1ccccc1)c1ccccc1.
What is the InChIKey of N-[(1S,2R)-2-hydroxy-1-phenylpropyl]benzamide?
The InChIKey is LNPDNDIGGRBFTO-IUODEOHRSA-N. The full InChI is InChI=1S/C16H17NO2/c1-12(18)15(13-8-4-2-5-9-13)17-16(19)14-10-6-3-7-11-14/h2-12,15,18H,1H3,(H,17,19)/t12-,15-/m1/s1.
What are the key properties of N-[(1S,2R)-2-hydroxy-1-phenylpropyl]benzamide?
N-[(1S,2R)-2-hydroxy-1-phenylpropyl]benzamide has a molecular weight of 255.32 g/mol, XLogP of 2.54, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1S,2R)-2-hydroxy-1-phenylpropyl]benzamide is sourced from PubChem (CID 6934600), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).