N-[(2-methylphenyl)methyl]-3-(2-oxo-1,3-oxazolidin-3-yl)propanamide

C14H18N2O3 — CID 110686856

IUPACN-[(2-methylphenyl)methyl]-3-(2-oxo-1,3-oxazolidin-3-yl)propanamide
SMILESCc1ccccc1CNC(=O)CCN1CCOC1=O
InChIInChI=1S/C14H18N2O3/c1-11-4-2-3-5-12(11)10-15-13(17)6-7-16-8-9-19-14(16)18/h2-5H,6-10H2,1H3,(H,15,17)
InChIKeyFTCFTPUFGLCIBZ-UHFFFAOYSA-N
MW262.31 g/mol
LogP1.45
Rot. Bonds5

About N-[(2-methylphenyl)methyl]-3-(2-oxo-1,3-oxazolidin-3-yl)propanamide

N-[(2-methylphenyl)methyl]-3-(2-oxo-1,3-oxazolidin-3-yl)propanamide (PubChem CID 110686856) has the molecular formula C14H18N2O3 and a molecular weight of 262.31 g/mol. Its IUPAC name is N-[(2-methylphenyl)methyl]-3-(2-oxo-1,3-oxazolidin-3-yl)propanamide.

Molecular Properties

Compound NameN-[(2-methylphenyl)methyl]-3-(2-oxo-1,3-oxazolidin-3-yl)propanamide
PubChem CID110686856
Molecular FormulaC14H18N2O3
Molecular Weight262.31 g/mol
Exact Mass262.13
IUPAC NameN-[(2-methylphenyl)methyl]-3-(2-oxo-1,3-oxazolidin-3-yl)propanamide
SMILESCc1ccccc1CNC(=O)CCN1CCOC1=O
InChIInChI=1S/C14H18N2O3/c1-11-4-2-3-5-12(11)10-15-13(17)6-7-16-8-9-19-14(16)18/h2-5H,6-10H2,1H3,(H,15,17)
InChIKeyFTCFTPUFGLCIBZ-UHFFFAOYSA-N
XLogP1.45
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.31
LogP ≤ 51.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[(2-methylphenyl)methyl]-3-(2-oxo-1,3-oxazolidin-3-yl)propanamide?
The IUPAC name of N-[(2-methylphenyl)methyl]-3-(2-oxo-1,3-oxazolidin-3-yl)propanamide (CID 110686856) is N-[(2-methylphenyl)methyl]-3-(2-oxo-1,3-oxazolidin-3-yl)propanamide.
What is the SMILES notation for N-[(2-methylphenyl)methyl]-3-(2-oxo-1,3-oxazolidin-3-yl)propanamide?
The canonical SMILES for N-[(2-methylphenyl)methyl]-3-(2-oxo-1,3-oxazolidin-3-yl)propanamide is Cc1ccccc1CNC(=O)CCN1CCOC1=O.
What is the InChIKey of N-[(2-methylphenyl)methyl]-3-(2-oxo-1,3-oxazolidin-3-yl)propanamide?
The InChIKey is FTCFTPUFGLCIBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2O3/c1-11-4-2-3-5-12(11)10-15-13(17)6-7-16-8-9-19-14(16)18/h2-5H,6-10H2,1H3,(H,15,17).
What are the key properties of N-[(2-methylphenyl)methyl]-3-(2-oxo-1,3-oxazolidin-3-yl)propanamide?
N-[(2-methylphenyl)methyl]-3-(2-oxo-1,3-oxazolidin-3-yl)propanamide has a molecular weight of 262.31 g/mol, XLogP of 1.45, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-methylphenyl)methyl]-3-(2-oxo-1,3-oxazolidin-3-yl)propanamide is sourced from PubChem (CID 110686856), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).