N-[(2S)-1-hydroxy-3-phenylpropan-2-yl]-N-methyl-2-phenylacetamide

C18H21NO2 — CID 2106709

IUPACN-[(2S)-1-hydroxy-3-phenylpropan-2-yl]-N-methyl-2-phenylacetamide
SMILESCN(C(=O)Cc1ccccc1)[C@H](CO)Cc1ccccc1
InChIInChI=1S/C18H21NO2/c1-19(18(21)13-16-10-6-3-7-11-16)17(14-20)12-15-8-4-2-5-9-15/h2-11,17,20H,12-14H2,1H3/t17-/m0/s1
InChIKeyUZGIALYOQDDYNC-KRWDZBQOSA-N
MW283.37 g/mol
LogP2.29
Rot. Bonds6

About N-[(2S)-1-hydroxy-3-phenylpropan-2-yl]-N-methyl-2-phenylacetamide

N-[(2S)-1-hydroxy-3-phenylpropan-2-yl]-N-methyl-2-phenylacetamide (PubChem CID 2106709) has the molecular formula C18H21NO2 and a molecular weight of 283.37 g/mol. Its IUPAC name is N-[(2S)-1-hydroxy-3-phenylpropan-2-yl]-N-methyl-2-phenylacetamide.

Molecular Properties

Compound NameN-[(2S)-1-hydroxy-3-phenylpropan-2-yl]-N-methyl-2-phenylacetamide
PubChem CID2106709
Molecular FormulaC18H21NO2
Molecular Weight283.37 g/mol
Exact Mass283.16
IUPAC NameN-[(2S)-1-hydroxy-3-phenylpropan-2-yl]-N-methyl-2-phenylacetamide
SMILESCN(C(=O)Cc1ccccc1)[C@H](CO)Cc1ccccc1
InChIInChI=1S/C18H21NO2/c1-19(18(21)13-16-10-6-3-7-11-16)17(14-20)12-15-8-4-2-5-9-15/h2-11,17,20H,12-14H2,1H3/t17-/m0/s1
InChIKeyUZGIALYOQDDYNC-KRWDZBQOSA-N
XLogP2.29
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.37
LogP ≤ 52.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(3,5-dimethylthiophen-2-yl)-N-(1-hydroxy-3-phenylpropan-2-yl)-N-methylacetamide
CID 138029616
N-[(2R)-1-hydroxy-3-phenylpropan-2-yl]-N,3,5-trimethylbenzamide
CID 18663405
N-(1-hydroxy-1-phenylpropan-2-yl)-N-methyl-2-phenylacetamide
CID 54856748
tert-butyl-[(2S)-1-hydroxy-3-phenylpropan-2-yl]carbamic acid
CID 68898508
N-benzhydryl-N-methyl-2-(4-phenylphenyl)acetamide
CID 2103734
3-(2-aminophenyl)-N-methyl-N-(1-phenylbutan-2-yl)propanamide
CID 120611344
4-amino-N-methyl-N-(1-phenylbutan-2-yl)pentanamide;hydrochloride
CID 120563414
(2R)-2-(dipropylamino)-3-phenylpropan-1-ol
CID 107861512
N,N-dimethyl-1-phenylbutan-2-amine
CID 14527584
N-methyl-2-phenyl-N-(1-phenyl-2-pyrrolidin-1-ylethyl)acetamide
CID 3298213
N-methyl-2-phenyl-N-[(1R)-1-phenyl-2-pyrrolidin-1-ylethyl]acetamide
CID 86268656
3-amino-N-methyl-3-phenyl-N-(1-phenylbutan-2-yl)propanamide;hydrochloride
CID 119952076

Frequently Asked Questions

What is the IUPAC name of N-[(2S)-1-hydroxy-3-phenylpropan-2-yl]-N-methyl-2-phenylacetamide?
The IUPAC name of N-[(2S)-1-hydroxy-3-phenylpropan-2-yl]-N-methyl-2-phenylacetamide (CID 2106709) is N-[(2S)-1-hydroxy-3-phenylpropan-2-yl]-N-methyl-2-phenylacetamide.
What is the SMILES notation for N-[(2S)-1-hydroxy-3-phenylpropan-2-yl]-N-methyl-2-phenylacetamide?
The canonical SMILES for N-[(2S)-1-hydroxy-3-phenylpropan-2-yl]-N-methyl-2-phenylacetamide is CN(C(=O)Cc1ccccc1)[C@H](CO)Cc1ccccc1.
What is the InChIKey of N-[(2S)-1-hydroxy-3-phenylpropan-2-yl]-N-methyl-2-phenylacetamide?
The InChIKey is UZGIALYOQDDYNC-KRWDZBQOSA-N. The full InChI is InChI=1S/C18H21NO2/c1-19(18(21)13-16-10-6-3-7-11-16)17(14-20)12-15-8-4-2-5-9-15/h2-11,17,20H,12-14H2,1H3/t17-/m0/s1.
What are the key properties of N-[(2S)-1-hydroxy-3-phenylpropan-2-yl]-N-methyl-2-phenylacetamide?
N-[(2S)-1-hydroxy-3-phenylpropan-2-yl]-N-methyl-2-phenylacetamide has a molecular weight of 283.37 g/mol, XLogP of 2.29, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2S)-1-hydroxy-3-phenylpropan-2-yl]-N-methyl-2-phenylacetamide is sourced from PubChem (CID 2106709), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).