3-(3-methoxyphenyl)-N-propan-2-yl-4,5-dihydro-1,2-oxazole-5-carboxamide

C14H18N2O3 — CID 3238224

IUPAC3-(3-methoxyphenyl)-N-propan-2-yl-4,5-dihydro-1,2-oxazole-5-carboxamide
SMILESCOc1cccc(C2=NOC(C(=O)NC(C)C)C2)c1
InChIInChI=1S/C14H18N2O3/c1-9(2)15-14(17)13-8-12(16-19-13)10-5-4-6-11(7-10)18-3/h4-7,9,13H,8H2,1-3H3,(H,15,17)
InChIKeyBBADFNBWZHRNPK-UHFFFAOYSA-N
MW262.31 g/mol
LogP1.71
Rot. Bonds4

About 3-(3-methoxyphenyl)-N-propan-2-yl-4,5-dihydro-1,2-oxazole-5-carboxamide

3-(3-methoxyphenyl)-N-propan-2-yl-4,5-dihydro-1,2-oxazole-5-carboxamide (PubChem CID 3238224) has the molecular formula C14H18N2O3 and a molecular weight of 262.31 g/mol. Its IUPAC name is 3-(3-methoxyphenyl)-N-propan-2-yl-4,5-dihydro-1,2-oxazole-5-carboxamide.

Molecular Properties

Compound Name3-(3-methoxyphenyl)-N-propan-2-yl-4,5-dihydro-1,2-oxazole-5-carboxamide
PubChem CID3238224
Molecular FormulaC14H18N2O3
Molecular Weight262.31 g/mol
Exact Mass262.13
IUPAC Name3-(3-methoxyphenyl)-N-propan-2-yl-4,5-dihydro-1,2-oxazole-5-carboxamide
SMILESCOc1cccc(C2=NOC(C(=O)NC(C)C)C2)c1
InChIInChI=1S/C14H18N2O3/c1-9(2)15-14(17)13-8-12(16-19-13)10-5-4-6-11(7-10)18-3/h4-7,9,13H,8H2,1-3H3,(H,15,17)
InChIKeyBBADFNBWZHRNPK-UHFFFAOYSA-N
XLogP1.71
TPSA59.92 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.31
LogP ≤ 51.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 3-(3-methoxyphenyl)-N-propan-2-yl-4,5-dihydro-1,2-oxazole-5-carboxamide 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 3-(3-methoxyphenyl)-N-propan-2-yl-4,5-dihydro-1,2-oxazole-5-carboxamide?
The IUPAC name of 3-(3-methoxyphenyl)-N-propan-2-yl-4,5-dihydro-1,2-oxazole-5-carboxamide (CID 3238224) is 3-(3-methoxyphenyl)-N-propan-2-yl-4,5-dihydro-1,2-oxazole-5-carboxamide.
What is the SMILES notation for 3-(3-methoxyphenyl)-N-propan-2-yl-4,5-dihydro-1,2-oxazole-5-carboxamide?
The canonical SMILES for 3-(3-methoxyphenyl)-N-propan-2-yl-4,5-dihydro-1,2-oxazole-5-carboxamide is COc1cccc(C2=NOC(C(=O)NC(C)C)C2)c1.
What is the InChIKey of 3-(3-methoxyphenyl)-N-propan-2-yl-4,5-dihydro-1,2-oxazole-5-carboxamide?
The InChIKey is BBADFNBWZHRNPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2O3/c1-9(2)15-14(17)13-8-12(16-19-13)10-5-4-6-11(7-10)18-3/h4-7,9,13H,8H2,1-3H3,(H,15,17).
What are the key properties of 3-(3-methoxyphenyl)-N-propan-2-yl-4,5-dihydro-1,2-oxazole-5-carboxamide?
3-(3-methoxyphenyl)-N-propan-2-yl-4,5-dihydro-1,2-oxazole-5-carboxamide has a molecular weight of 262.31 g/mol, XLogP of 1.71, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-methoxyphenyl)-N-propan-2-yl-4,5-dihydro-1,2-oxazole-5-carboxamide is sourced from PubChem (CID 3238224), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).