4-amino-N-[4-(1,3-oxazol-5-yl)phenyl]cyclopent-2-ene-1-carboxamide

C15H15N3O2 — CID 79211350

IUPAC4-amino-N-[4-(1,3-oxazol-5-yl)phenyl]cyclopent-2-ene-1-carboxamide
SMILESNC1C=CC(C(=O)Nc2ccc(-c3cnco3)cc2)C1
InChIInChI=1S/C15H15N3O2/c16-12-4-1-11(7-12)15(19)18-13-5-2-10(3-6-13)14-8-17-9-20-14/h1-6,8-9,11-12H,7,16H2,(H,18,19)
InChIKeyBKCADQXTPCXODH-UHFFFAOYSA-N
MW269.30 g/mol
LogP2.18
Rot. Bonds3

About 4-amino-N-[4-(1,3-oxazol-5-yl)phenyl]cyclopent-2-ene-1-carboxamide

4-amino-N-[4-(1,3-oxazol-5-yl)phenyl]cyclopent-2-ene-1-carboxamide (PubChem CID 79211350) has the molecular formula C15H15N3O2 and a molecular weight of 269.30 g/mol. Its IUPAC name is 4-amino-N-[4-(1,3-oxazol-5-yl)phenyl]cyclopent-2-ene-1-carboxamide.

Molecular Properties

Compound Name4-amino-N-[4-(1,3-oxazol-5-yl)phenyl]cyclopent-2-ene-1-carboxamide
PubChem CID79211350
Molecular FormulaC15H15N3O2
Molecular Weight269.30 g/mol
Exact Mass269.12
IUPAC Name4-amino-N-[4-(1,3-oxazol-5-yl)phenyl]cyclopent-2-ene-1-carboxamide
SMILESNC1C=CC(C(=O)Nc2ccc(-c3cnco3)cc2)C1
InChIInChI=1S/C15H15N3O2/c16-12-4-1-11(7-12)15(19)18-13-5-2-10(3-6-13)14-8-17-9-20-14/h1-6,8-9,11-12H,7,16H2,(H,18,19)
InChIKeyBKCADQXTPCXODH-UHFFFAOYSA-N
XLogP2.18
TPSA81.15 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.30
LogP ≤ 52.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

Analyze 4-amino-N-[4-(1,3-oxazol-5-yl)phenyl]cyclopent-2-ene-1-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

2-amino-N-[4-(1,3-oxazol-5-yl)phenyl]cyclopropane-1-carboxamide
CID 114997982
(2S)-N-[4-(1,3-oxazol-5-yl)phenyl]oxolane-2-carboxamide
CID 99699200
2-(cyclopropylamino)-N-[4-(1,3-oxazol-5-yl)phenyl]acetamide
CID 54862582
4-amino-N-(3,4-dichlorophenyl)cyclopent-2-ene-1-carboxamide
CID 79210508
4-amino-N-(1,3-benzodioxol-5-yl)cyclopent-2-ene-1-carboxamide
CID 79210516
4-[4-(1,3-oxazol-5-yl)anilino]-4-oxobutanoic acid
CID 54866818
1-amino-N-[4-(1,3-oxazol-5-yl)phenyl]cyclopentane-1-carboxamide
CID 58677105
2,2-dimethyl-N-[4-(1,3-oxazol-5-yl)phenyl]propanamide
CID 2806322
4-[(4-aminocyclopent-2-ene-1-carbonyl)amino]-N,N-dimethylbenzamide
CID 79211253
4-amino-N-(4-ethoxyphenyl)cyclopent-2-ene-1-carboxamide
CID 79211304
2-(1-aminocyclopentyl)-N-[4-(1,3-oxazol-5-yl)phenyl]acetamide
CID 64684075
9-amino-N-[3-(1,3-oxazol-5-yl)phenyl]bicyclo[3.3.1]nonane-3-carboxamide
CID 120986715

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-[4-(1,3-oxazol-5-yl)phenyl]cyclopent-2-ene-1-carboxamide?
The IUPAC name of 4-amino-N-[4-(1,3-oxazol-5-yl)phenyl]cyclopent-2-ene-1-carboxamide (CID 79211350) is 4-amino-N-[4-(1,3-oxazol-5-yl)phenyl]cyclopent-2-ene-1-carboxamide.
What is the SMILES notation for 4-amino-N-[4-(1,3-oxazol-5-yl)phenyl]cyclopent-2-ene-1-carboxamide?
The canonical SMILES for 4-amino-N-[4-(1,3-oxazol-5-yl)phenyl]cyclopent-2-ene-1-carboxamide is NC1C=CC(C(=O)Nc2ccc(-c3cnco3)cc2)C1.
What is the InChIKey of 4-amino-N-[4-(1,3-oxazol-5-yl)phenyl]cyclopent-2-ene-1-carboxamide?
The InChIKey is BKCADQXTPCXODH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N3O2/c16-12-4-1-11(7-12)15(19)18-13-5-2-10(3-6-13)14-8-17-9-20-14/h1-6,8-9,11-12H,7,16H2,(H,18,19).
What are the key properties of 4-amino-N-[4-(1,3-oxazol-5-yl)phenyl]cyclopent-2-ene-1-carboxamide?
4-amino-N-[4-(1,3-oxazol-5-yl)phenyl]cyclopent-2-ene-1-carboxamide has a molecular weight of 269.30 g/mol, XLogP of 2.18, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-[4-(1,3-oxazol-5-yl)phenyl]cyclopent-2-ene-1-carboxamide is sourced from PubChem (CID 79211350), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).