N-methyl-N-[(2S)-1-(3-phenylphenyl)propan-2-yl]acetamide

C18H21NO — CID 121274891

IUPACN-methyl-N-[(2S)-1-(3-phenylphenyl)propan-2-yl]acetamide
SMILESCC(=O)N(C)[C@@H](C)Cc1cccc(-c2ccccc2)c1
InChIInChI=1S/C18H21NO/c1-14(19(3)15(2)20)12-16-8-7-11-18(13-16)17-9-5-4-6-10-17/h4-11,13-14H,12H2,1-3H3/t14-/m0/s1
InChIKeyMEMLYWNECBJVIZ-AWEZNQCLSA-N
MW267.37 g/mol
LogP3.76
Rot. Bonds4

About N-methyl-N-[(2S)-1-(3-phenylphenyl)propan-2-yl]acetamide

N-methyl-N-[(2S)-1-(3-phenylphenyl)propan-2-yl]acetamide (PubChem CID 121274891) has the molecular formula C18H21NO and a molecular weight of 267.37 g/mol. Its IUPAC name is N-methyl-N-[(2S)-1-(3-phenylphenyl)propan-2-yl]acetamide.

Molecular Properties

Compound NameN-methyl-N-[(2S)-1-(3-phenylphenyl)propan-2-yl]acetamide
PubChem CID121274891
Molecular FormulaC18H21NO
Molecular Weight267.37 g/mol
Exact Mass267.16
IUPAC NameN-methyl-N-[(2S)-1-(3-phenylphenyl)propan-2-yl]acetamide
SMILESCC(=O)N(C)[C@@H](C)Cc1cccc(-c2ccccc2)c1
InChIInChI=1S/C18H21NO/c1-14(19(3)15(2)20)12-16-8-7-11-18(13-16)17-9-5-4-6-10-17/h4-11,13-14H,12H2,1-3H3/t14-/m0/s1
InChIKeyMEMLYWNECBJVIZ-AWEZNQCLSA-N
XLogP3.76
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.37
LogP ≤ 53.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

N-[1-(3-ethoxyphenyl)propan-2-yl]-N-methylacetamide
CID 547381
3-[[3-(3-phenylphenyl)phenyl]methyl]pentane-2,4-dione
CID 70902423
N-methyl-N-[1-(4-methylphenyl)propan-2-yl]acetamide
CID 165361906
N-methyl-N-[(2S)-1-phenylpropan-2-yl]carbamoyl chloride
CID 167430953
2-(methylamino)-3-(3-phenylphenyl)propanoic acid
CID 59021845
4-[4-[2-[acetyl(methyl)amino]propyl]phenyl]-4-oxobutanoic acid
CID 12850263
ethyl 2-amino-3-[3-(4-methoxyphenyl)phenyl]propanoate
CID 170884966
1-ethyl-3-phenylbenzene;propane
CID 145466525
(2S)-2-amino-3-[3-(3-methylphenyl)phenyl]propanoic acid
CID 172529545
ethyl (2R)-2-amino-3-[3-(4-phenylmethoxyphenyl)phenyl]propanoate
CID 154815424
5-[4-[(2R)-2-[acetyl(methyl)amino]propyl]phenyl]-5-oxopentanoic acid
CID 57187704
2-amino-3-[3-(4-chlorophenyl)phenyl]propanoic acid
CID 170879584

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[(2S)-1-(3-phenylphenyl)propan-2-yl]acetamide?
The IUPAC name of N-methyl-N-[(2S)-1-(3-phenylphenyl)propan-2-yl]acetamide (CID 121274891) is N-methyl-N-[(2S)-1-(3-phenylphenyl)propan-2-yl]acetamide.
What is the SMILES notation for N-methyl-N-[(2S)-1-(3-phenylphenyl)propan-2-yl]acetamide?
The canonical SMILES for N-methyl-N-[(2S)-1-(3-phenylphenyl)propan-2-yl]acetamide is CC(=O)N(C)[C@@H](C)Cc1cccc(-c2ccccc2)c1.
What is the InChIKey of N-methyl-N-[(2S)-1-(3-phenylphenyl)propan-2-yl]acetamide?
The InChIKey is MEMLYWNECBJVIZ-AWEZNQCLSA-N. The full InChI is InChI=1S/C18H21NO/c1-14(19(3)15(2)20)12-16-8-7-11-18(13-16)17-9-5-4-6-10-17/h4-11,13-14H,12H2,1-3H3/t14-/m0/s1.
What are the key properties of N-methyl-N-[(2S)-1-(3-phenylphenyl)propan-2-yl]acetamide?
N-methyl-N-[(2S)-1-(3-phenylphenyl)propan-2-yl]acetamide has a molecular weight of 267.37 g/mol, XLogP of 3.76, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[(2S)-1-(3-phenylphenyl)propan-2-yl]acetamide is sourced from PubChem (CID 121274891), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).