4-cyclopropyl-N-(2-phenylethyl)-1,2-oxazole-3-carboxamide

C15H16N2O2 — CID 140824522

IUPAC4-cyclopropyl-N-(2-phenylethyl)-1,2-oxazole-3-carboxamide
SMILESO=C(NCCc1ccccc1)c1nocc1C1CC1
InChIInChI=1S/C15H16N2O2/c18-15(14-13(10-19-17-14)12-6-7-12)16-9-8-11-4-2-1-3-5-11/h1-5,10,12H,6-9H2,(H,16,18)
InChIKeyJVNMTNKTSKWAGN-UHFFFAOYSA-N
MW256.31 g/mol
LogP2.52
Rot. Bonds5

About 4-cyclopropyl-N-(2-phenylethyl)-1,2-oxazole-3-carboxamide

4-cyclopropyl-N-(2-phenylethyl)-1,2-oxazole-3-carboxamide (PubChem CID 140824522) has the molecular formula C15H16N2O2 and a molecular weight of 256.31 g/mol. Its IUPAC name is 4-cyclopropyl-N-(2-phenylethyl)-1,2-oxazole-3-carboxamide.

Molecular Properties

Compound Name4-cyclopropyl-N-(2-phenylethyl)-1,2-oxazole-3-carboxamide
PubChem CID140824522
Molecular FormulaC15H16N2O2
Molecular Weight256.31 g/mol
Exact Mass256.12
IUPAC Name4-cyclopropyl-N-(2-phenylethyl)-1,2-oxazole-3-carboxamide
SMILESO=C(NCCc1ccccc1)c1nocc1C1CC1
InChIInChI=1S/C15H16N2O2/c18-15(14-13(10-19-17-14)12-6-7-12)16-9-8-11-4-2-1-3-5-11/h1-5,10,12H,6-9H2,(H,16,18)
InChIKeyJVNMTNKTSKWAGN-UHFFFAOYSA-N
XLogP2.52
TPSA55.13 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.31
LogP ≤ 52.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-phenyl-N-(2-phenylethyl)-1,2-oxazole-4-carboxamide
CID 100771698
1-N,4-N-bis(2-phenylethyl)benzene-1,4-dicarboxamide
CID 984633
(5R)-5-methyl-N-(2-phenylethyl)-4,5,6,7-tetrahydro-1,2-benzoxazole-3-carboxamide
CID 29056649
5-methyl-N-(2-phenylethyl)-4,5-dihydro-1H-imidazole-2-carboxamide
CID 91902231
3-(2-phenylethylcarbamoyl)pyrazine-2-carboxylic acid
CID 1207738
2-phenylethylcarbamothioic S-acid
CID 11116669
2-amino-N-(2-phenylethyl)-1,3-oxazole-4-carboxamide
CID 110852301
3-(2-phenylethylcarbamoyl)pyrazine-2-carboxylate
CID 6974189
N-(2-phenylethyl)-3-phenylmethoxy-1,2-oxazole-5-carboxamide
CID 90574114
5-cyclopropyl-N-[2-(3-fluorophenyl)ethyl]-2-phenyl-1,3-oxazole-4-carboxamide
CID 86841042
N-(2-phenylethyl)-5,6-dihydro-4H-1,3-oxazine-2-carboxamide
CID 20523783
3-cyclopropyl-N-(2-pyridin-3-ylethyl)quinoxaline-2-carboxamide
CID 125420088

Frequently Asked Questions

What is the IUPAC name of 4-cyclopropyl-N-(2-phenylethyl)-1,2-oxazole-3-carboxamide?
The IUPAC name of 4-cyclopropyl-N-(2-phenylethyl)-1,2-oxazole-3-carboxamide (CID 140824522) is 4-cyclopropyl-N-(2-phenylethyl)-1,2-oxazole-3-carboxamide.
What is the SMILES notation for 4-cyclopropyl-N-(2-phenylethyl)-1,2-oxazole-3-carboxamide?
The canonical SMILES for 4-cyclopropyl-N-(2-phenylethyl)-1,2-oxazole-3-carboxamide is O=C(NCCc1ccccc1)c1nocc1C1CC1.
What is the InChIKey of 4-cyclopropyl-N-(2-phenylethyl)-1,2-oxazole-3-carboxamide?
The InChIKey is JVNMTNKTSKWAGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2O2/c18-15(14-13(10-19-17-14)12-6-7-12)16-9-8-11-4-2-1-3-5-11/h1-5,10,12H,6-9H2,(H,16,18).
What are the key properties of 4-cyclopropyl-N-(2-phenylethyl)-1,2-oxazole-3-carboxamide?
4-cyclopropyl-N-(2-phenylethyl)-1,2-oxazole-3-carboxamide has a molecular weight of 256.31 g/mol, XLogP of 2.52, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyclopropyl-N-(2-phenylethyl)-1,2-oxazole-3-carboxamide is sourced from PubChem (CID 140824522), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).