ethyl N-[(5-methyl-4-phenyl-1,3-oxazol-2-yl)methyl]carbamate

C14H16N2O3 — CID 110666364

IUPACethyl N-[(5-methyl-4-phenyl-1,3-oxazol-2-yl)methyl]carbamate
SMILESCCOC(=O)NCc1nc(-c2ccccc2)c(C)o1
InChIInChI=1S/C14H16N2O3/c1-3-18-14(17)15-9-12-16-13(10(2)19-12)11-7-5-4-6-8-11/h4-8H,3,9H2,1-2H3,(H,15,17)
InChIKeySXMLDTSFRGZGNR-UHFFFAOYSA-N
MW260.29 g/mol
LogP2.90
Rot. Bonds4

About ethyl N-[(5-methyl-4-phenyl-1,3-oxazol-2-yl)methyl]carbamate

ethyl N-[(5-methyl-4-phenyl-1,3-oxazol-2-yl)methyl]carbamate (PubChem CID 110666364) has the molecular formula C14H16N2O3 and a molecular weight of 260.29 g/mol. Its IUPAC name is ethyl N-[(5-methyl-4-phenyl-1,3-oxazol-2-yl)methyl]carbamate.

Molecular Properties

Compound Nameethyl N-[(5-methyl-4-phenyl-1,3-oxazol-2-yl)methyl]carbamate
PubChem CID110666364
Molecular FormulaC14H16N2O3
Molecular Weight260.29 g/mol
Exact Mass260.12
IUPAC Nameethyl N-[(5-methyl-4-phenyl-1,3-oxazol-2-yl)methyl]carbamate
SMILESCCOC(=O)NCc1nc(-c2ccccc2)c(C)o1
InChIInChI=1S/C14H16N2O3/c1-3-18-14(17)15-9-12-16-13(10(2)19-12)11-7-5-4-6-8-11/h4-8H,3,9H2,1-2H3,(H,15,17)
InChIKeySXMLDTSFRGZGNR-UHFFFAOYSA-N
XLogP2.90
TPSA64.36 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.29
LogP ≤ 52.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze ethyl N-[(5-methyl-4-phenyl-1,3-oxazol-2-yl)methyl]carbamate with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of ethyl N-[(5-methyl-4-phenyl-1,3-oxazol-2-yl)methyl]carbamate?
The IUPAC name of ethyl N-[(5-methyl-4-phenyl-1,3-oxazol-2-yl)methyl]carbamate (CID 110666364) is ethyl N-[(5-methyl-4-phenyl-1,3-oxazol-2-yl)methyl]carbamate.
What is the SMILES notation for ethyl N-[(5-methyl-4-phenyl-1,3-oxazol-2-yl)methyl]carbamate?
The canonical SMILES for ethyl N-[(5-methyl-4-phenyl-1,3-oxazol-2-yl)methyl]carbamate is CCOC(=O)NCc1nc(-c2ccccc2)c(C)o1.
What is the InChIKey of ethyl N-[(5-methyl-4-phenyl-1,3-oxazol-2-yl)methyl]carbamate?
The InChIKey is SXMLDTSFRGZGNR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O3/c1-3-18-14(17)15-9-12-16-13(10(2)19-12)11-7-5-4-6-8-11/h4-8H,3,9H2,1-2H3,(H,15,17).
What are the key properties of ethyl N-[(5-methyl-4-phenyl-1,3-oxazol-2-yl)methyl]carbamate?
ethyl N-[(5-methyl-4-phenyl-1,3-oxazol-2-yl)methyl]carbamate has a molecular weight of 260.29 g/mol, XLogP of 2.90, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl N-[(5-methyl-4-phenyl-1,3-oxazol-2-yl)methyl]carbamate is sourced from PubChem (CID 110666364), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).