N-pentan-2-yl-5-phenyl-1,2-oxazole-3-carboxamide

C15H18N2O2 — CID 133149969

IUPACN-pentan-2-yl-5-phenyl-1,2-oxazole-3-carboxamide
SMILESCCCC(C)NC(=O)c1cc(-c2ccccc2)on1
InChIInChI=1S/C15H18N2O2/c1-3-7-11(2)16-15(18)13-10-14(19-17-13)12-8-5-4-6-9-12/h4-6,8-11H,3,7H2,1-2H3,(H,16,18)
InChIKeyCYXQNHHLRXQGIR-UHFFFAOYSA-N
MW258.32 g/mol
LogP3.26
Rot. Bonds5

About N-pentan-2-yl-5-phenyl-1,2-oxazole-3-carboxamide

N-pentan-2-yl-5-phenyl-1,2-oxazole-3-carboxamide (PubChem CID 133149969) has the molecular formula C15H18N2O2 and a molecular weight of 258.32 g/mol. Its IUPAC name is N-pentan-2-yl-5-phenyl-1,2-oxazole-3-carboxamide.

Molecular Properties

Compound NameN-pentan-2-yl-5-phenyl-1,2-oxazole-3-carboxamide
PubChem CID133149969
Molecular FormulaC15H18N2O2
Molecular Weight258.32 g/mol
Exact Mass258.14
IUPAC NameN-pentan-2-yl-5-phenyl-1,2-oxazole-3-carboxamide
SMILESCCCC(C)NC(=O)c1cc(-c2ccccc2)on1
InChIInChI=1S/C15H18N2O2/c1-3-7-11(2)16-15(18)13-10-14(19-17-13)12-8-5-4-6-9-12/h4-6,8-11H,3,7H2,1-2H3,(H,16,18)
InChIKeyCYXQNHHLRXQGIR-UHFFFAOYSA-N
XLogP3.26
TPSA55.13 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.32
LogP ≤ 53.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-pentan-2-yl-5-phenyl-1,2-oxazole-3-carboxamide with MolForge

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

Launch Full Analysis

Related Compounds

5-(3-methylphenyl)-N-pentan-2-yl-1,2-oxazole-3-carboxamide
CID 46087302
5-(4-fluorophenyl)-N-pentan-2-yl-1,2-oxazole-3-carboxamide
CID 133149974
N-[1-(5-methyl-1H-pyrazol-3-yl)propan-2-yl]-5-phenyl-1,2-oxazole-3-carboxamide
CID 70708653
N-[(2S)-butan-2-yl]-5-(4-fluorophenyl)-1,2-oxazole-3-carboxamide
CID 41098446
N-[2-(methylamino)propyl]-5-phenyl-1,2-oxazole-3-carboxamide
CID 120827875
N-(2-hydroxypropyl)-5-phenyl-1,2-oxazole-3-carboxamide
CID 43418328
N-[2-(3-methylbutan-2-ylamino)-2-oxoethyl]-5-phenyl-1,2-oxazole-3-carboxamide
CID 51103232
N-(3-hydroxy-2-methylpropyl)-5-phenyl-1,2-oxazole-3-carboxamide
CID 65031495
(2S)-2-[(5-thiophen-2-yl-1,2-oxazole-3-carbonyl)amino]pentanoic acid
CID 107564210
N-(1-aminoprop-2-enyl)-5-phenyl-1,2-oxazole-3-carboxamide
CID 118877210
3-cyclopropyl-3-[(5-phenyl-1,2-oxazole-3-carbonyl)amino]propanoic acid
CID 75429233
N-[(1S)-1-(4-methylsulfonylphenyl)ethyl]-5-phenyl-1,2-oxazole-3-carboxamide
CID 31883285

Frequently Asked Questions

What is the IUPAC name of N-pentan-2-yl-5-phenyl-1,2-oxazole-3-carboxamide?
The IUPAC name of N-pentan-2-yl-5-phenyl-1,2-oxazole-3-carboxamide (CID 133149969) is N-pentan-2-yl-5-phenyl-1,2-oxazole-3-carboxamide.
What is the SMILES notation for N-pentan-2-yl-5-phenyl-1,2-oxazole-3-carboxamide?
The canonical SMILES for N-pentan-2-yl-5-phenyl-1,2-oxazole-3-carboxamide is CCCC(C)NC(=O)c1cc(-c2ccccc2)on1.
What is the InChIKey of N-pentan-2-yl-5-phenyl-1,2-oxazole-3-carboxamide?
The InChIKey is CYXQNHHLRXQGIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O2/c1-3-7-11(2)16-15(18)13-10-14(19-17-13)12-8-5-4-6-9-12/h4-6,8-11H,3,7H2,1-2H3,(H,16,18).
What are the key properties of N-pentan-2-yl-5-phenyl-1,2-oxazole-3-carboxamide?
N-pentan-2-yl-5-phenyl-1,2-oxazole-3-carboxamide has a molecular weight of 258.32 g/mol, XLogP of 3.26, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-pentan-2-yl-5-phenyl-1,2-oxazole-3-carboxamide is sourced from PubChem (CID 133149969), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).