N-(5-methyl-1,2-oxazol-3-yl)-5-oxo-1-phenylpyrrolidine-3-carboxamide

C15H15N3O3 — CID 2964340

IUPACN-(5-methyl-1,2-oxazol-3-yl)-5-oxo-1-phenylpyrrolidine-3-carboxamide
SMILESCc1cc(NC(=O)C2CC(=O)N(c3ccccc3)C2)no1
InChIInChI=1S/C15H15N3O3/c1-10-7-13(17-21-10)16-15(20)11-8-14(19)18(9-11)12-5-3-2-4-6-12/h2-7,11H,8-9H2,1H3,(H,16,17,20)
InChIKeyUDCMCXJTNTUNIW-UHFFFAOYSA-N
MW285.30 g/mol
LogP1.97
Rot. Bonds3

About N-(5-methyl-1,2-oxazol-3-yl)-5-oxo-1-phenylpyrrolidine-3-carboxamide

N-(5-methyl-1,2-oxazol-3-yl)-5-oxo-1-phenylpyrrolidine-3-carboxamide (PubChem CID 2964340) has the molecular formula C15H15N3O3 and a molecular weight of 285.30 g/mol. Its IUPAC name is N-(5-methyl-1,2-oxazol-3-yl)-5-oxo-1-phenylpyrrolidine-3-carboxamide.

Molecular Properties

Compound NameN-(5-methyl-1,2-oxazol-3-yl)-5-oxo-1-phenylpyrrolidine-3-carboxamide
PubChem CID2964340
Molecular FormulaC15H15N3O3
Molecular Weight285.30 g/mol
Exact Mass285.11
IUPAC NameN-(5-methyl-1,2-oxazol-3-yl)-5-oxo-1-phenylpyrrolidine-3-carboxamide
SMILESCc1cc(NC(=O)C2CC(=O)N(c3ccccc3)C2)no1
InChIInChI=1S/C15H15N3O3/c1-10-7-13(17-21-10)16-15(20)11-8-14(19)18(9-11)12-5-3-2-4-6-12/h2-7,11H,8-9H2,1H3,(H,16,17,20)
InChIKeyUDCMCXJTNTUNIW-UHFFFAOYSA-N
XLogP1.97
TPSA75.44 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.30
LogP ≤ 51.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(5-methyl-1,2-oxazol-3-yl)-5-oxo-1-phenylpyrrolidine-3-carboxamide?
The IUPAC name of N-(5-methyl-1,2-oxazol-3-yl)-5-oxo-1-phenylpyrrolidine-3-carboxamide (CID 2964340) is N-(5-methyl-1,2-oxazol-3-yl)-5-oxo-1-phenylpyrrolidine-3-carboxamide.
What is the SMILES notation for N-(5-methyl-1,2-oxazol-3-yl)-5-oxo-1-phenylpyrrolidine-3-carboxamide?
The canonical SMILES for N-(5-methyl-1,2-oxazol-3-yl)-5-oxo-1-phenylpyrrolidine-3-carboxamide is Cc1cc(NC(=O)C2CC(=O)N(c3ccccc3)C2)no1.
What is the InChIKey of N-(5-methyl-1,2-oxazol-3-yl)-5-oxo-1-phenylpyrrolidine-3-carboxamide?
The InChIKey is UDCMCXJTNTUNIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N3O3/c1-10-7-13(17-21-10)16-15(20)11-8-14(19)18(9-11)12-5-3-2-4-6-12/h2-7,11H,8-9H2,1H3,(H,16,17,20).
What are the key properties of N-(5-methyl-1,2-oxazol-3-yl)-5-oxo-1-phenylpyrrolidine-3-carboxamide?
N-(5-methyl-1,2-oxazol-3-yl)-5-oxo-1-phenylpyrrolidine-3-carboxamide has a molecular weight of 285.30 g/mol, XLogP of 1.97, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-methyl-1,2-oxazol-3-yl)-5-oxo-1-phenylpyrrolidine-3-carboxamide is sourced from PubChem (CID 2964340), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).