(2S)-2-methyl-N-[3-(2-oxo-1,3-oxazolidin-3-yl)phenyl]-5-phenylpentanamide

C21H24N2O3 — CID 97258741

IUPAC(2S)-2-methyl-N-[3-(2-oxo-1,3-oxazolidin-3-yl)phenyl]-5-phenylpentanamide
SMILESC[C@@H](CCCc1ccccc1)C(=O)Nc1cccc(N2CCOC2=O)c1
InChIInChI=1S/C21H24N2O3/c1-16(7-5-10-17-8-3-2-4-9-17)20(24)22-18-11-6-12-19(15-18)23-13-14-26-21(23)25/h2-4,6,8-9,11-12,15-16H,5,7,10,13-14H2,1H3,(H,22,24)/t16-/m0/s1
InChIKeyPMKLCAKCTVWKPI-INIZCTEOSA-N
MW352.43 g/mol
LogP4.24
Rot. Bonds7

About (2S)-2-methyl-N-[3-(2-oxo-1,3-oxazolidin-3-yl)phenyl]-5-phenylpentanamide

(2S)-2-methyl-N-[3-(2-oxo-1,3-oxazolidin-3-yl)phenyl]-5-phenylpentanamide (PubChem CID 97258741) has the molecular formula C21H24N2O3 and a molecular weight of 352.43 g/mol. Its IUPAC name is (2S)-2-methyl-N-[3-(2-oxo-1,3-oxazolidin-3-yl)phenyl]-5-phenylpentanamide.

Molecular Properties

Compound Name(2S)-2-methyl-N-[3-(2-oxo-1,3-oxazolidin-3-yl)phenyl]-5-phenylpentanamide
PubChem CID97258741
Molecular FormulaC21H24N2O3
Molecular Weight352.43 g/mol
Exact Mass352.18
IUPAC Name(2S)-2-methyl-N-[3-(2-oxo-1,3-oxazolidin-3-yl)phenyl]-5-phenylpentanamide
SMILESC[C@@H](CCCc1ccccc1)C(=O)Nc1cccc(N2CCOC2=O)c1
InChIInChI=1S/C21H24N2O3/c1-16(7-5-10-17-8-3-2-4-9-17)20(24)22-18-11-6-12-19(15-18)23-13-14-26-21(23)25/h2-4,6,8-9,11-12,15-16H,5,7,10,13-14H2,1H3,(H,22,24)/t16-/m0/s1
InChIKeyPMKLCAKCTVWKPI-INIZCTEOSA-N
XLogP4.24
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.43
LogP ≤ 54.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[3-(2-oxo-1,3-oxazolidin-3-yl)phenyl]-2-phenylacetamide
CID 110874037
2-amino-4-methoxy-N-[3-(2-oxo-1,3-oxazolidin-3-yl)phenyl]butanamide
CID 62475194
(2S)-2-amino-3,3-dimethyl-N-[3-(2-oxo-1,3-oxazolidin-3-yl)phenyl]butanamide
CID 61178628
N-[3-(2-oxo-1,3-oxazolidin-3-yl)phenyl]-2-phenyl-2-phenylsulfanylacetamide
CID 55610055
1-benzyl-3,5-dimethyl-N-[3-(2-oxo-1,3-oxazolidin-3-yl)phenyl]pyrazole-4-carboxamide
CID 55617228
1-(2-methylpropyl)-3-[[3-(2-oxo-1,3-oxazolidin-3-yl)phenyl]methyl]urea
CID 60562162
2,2,3,3-tetrafluoro-N-[3-(2-oxo-1,3-oxazolidin-3-yl)phenyl]propanamide
CID 103732683
N-(2-methoxyethyl)-3-(2-oxo-1,3-oxazolidin-3-yl)-N-(3-phenylpropyl)benzamide
CID 60596922
5-amino-2-methyl-N-(3-pyrrolidin-1-ylphenyl)pentanamide
CID 104684218
(2R,3S)-2,3-dimethyl-N-[3-(2-oxo-1,3-oxazolidin-3-yl)phenyl]thiomorpholine-4-carboxamide
CID 97022624
(2S,3R)-2,3-dimethyl-N-[3-(2-oxo-1,3-oxazolidin-3-yl)phenyl]thiomorpholine-4-carboxamide
CID 97022621
3-[3-[2-(tert-butylamino)ethylamino]phenyl]-1,3-oxazolidin-2-one
CID 107445145

Frequently Asked Questions

What is the IUPAC name of (2S)-2-methyl-N-[3-(2-oxo-1,3-oxazolidin-3-yl)phenyl]-5-phenylpentanamide?
The IUPAC name of (2S)-2-methyl-N-[3-(2-oxo-1,3-oxazolidin-3-yl)phenyl]-5-phenylpentanamide (CID 97258741) is (2S)-2-methyl-N-[3-(2-oxo-1,3-oxazolidin-3-yl)phenyl]-5-phenylpentanamide.
What is the SMILES notation for (2S)-2-methyl-N-[3-(2-oxo-1,3-oxazolidin-3-yl)phenyl]-5-phenylpentanamide?
The canonical SMILES for (2S)-2-methyl-N-[3-(2-oxo-1,3-oxazolidin-3-yl)phenyl]-5-phenylpentanamide is C[C@@H](CCCc1ccccc1)C(=O)Nc1cccc(N2CCOC2=O)c1.
What is the InChIKey of (2S)-2-methyl-N-[3-(2-oxo-1,3-oxazolidin-3-yl)phenyl]-5-phenylpentanamide?
The InChIKey is PMKLCAKCTVWKPI-INIZCTEOSA-N. The full InChI is InChI=1S/C21H24N2O3/c1-16(7-5-10-17-8-3-2-4-9-17)20(24)22-18-11-6-12-19(15-18)23-13-14-26-21(23)25/h2-4,6,8-9,11-12,15-16H,5,7,10,13-14H2,1H3,(H,22,24)/t16-/m0/s1.
What are the key properties of (2S)-2-methyl-N-[3-(2-oxo-1,3-oxazolidin-3-yl)phenyl]-5-phenylpentanamide?
(2S)-2-methyl-N-[3-(2-oxo-1,3-oxazolidin-3-yl)phenyl]-5-phenylpentanamide has a molecular weight of 352.43 g/mol, XLogP of 4.24, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-methyl-N-[3-(2-oxo-1,3-oxazolidin-3-yl)phenyl]-5-phenylpentanamide is sourced from PubChem (CID 97258741), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).