[3-(2-phenyl-1,3-oxazol-4-yl)phenyl]methanamine

C16H14N2O — CID 115046706

IUPAC[3-(2-phenyl-1,3-oxazol-4-yl)phenyl]methanamine
SMILESNCc1cccc(-c2coc(-c3ccccc3)n2)c1
InChIInChI=1S/C16H14N2O/c17-10-12-5-4-8-14(9-12)15-11-19-16(18-15)13-6-2-1-3-7-13/h1-9,11H,10,17H2
InChIKeyUKIXZYOTYGOJIX-UHFFFAOYSA-N
MW250.30 g/mol
LogP3.47
Rot. Bonds3

About [3-(2-phenyl-1,3-oxazol-4-yl)phenyl]methanamine

[3-(2-phenyl-1,3-oxazol-4-yl)phenyl]methanamine (PubChem CID 115046706) has the molecular formula C16H14N2O and a molecular weight of 250.30 g/mol. Its IUPAC name is [3-(2-phenyl-1,3-oxazol-4-yl)phenyl]methanamine.

Molecular Properties

Compound Name[3-(2-phenyl-1,3-oxazol-4-yl)phenyl]methanamine
PubChem CID115046706
Molecular FormulaC16H14N2O
Molecular Weight250.30 g/mol
Exact Mass250.11
IUPAC Name[3-(2-phenyl-1,3-oxazol-4-yl)phenyl]methanamine
SMILESNCc1cccc(-c2coc(-c3ccccc3)n2)c1
InChIInChI=1S/C16H14N2O/c17-10-12-5-4-8-14(9-12)15-11-19-16(18-15)13-6-2-1-3-7-13/h1-9,11H,10,17H2
InChIKeyUKIXZYOTYGOJIX-UHFFFAOYSA-N
XLogP3.47
TPSA52.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.30
LogP ≤ 53.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze [3-(2-phenyl-1,3-oxazol-4-yl)phenyl]methanamine 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

[3-[2-(trifluoromethyl)-1,3-oxazol-4-yl]phenyl]methanamine
CID 115044579
[3-[(2-phenyl-1,3-oxazol-4-yl)methoxy]phenyl]methanamine
CID 106485084
4-(2-phenyl-1,3-oxazol-4-yl)benzene-1,2-diol
CID 115047090
3-(4-phenyl-1,3-oxazol-2-yl)phenol
CID 115041984
2-(4-chlorophenyl)-4-phenyl-1,3-oxazole
CID 15358896
(3-quinoxalin-2-ylphenyl)methanamine
CID 174907322
[3-(2-benzyl-1,3-thiazol-4-yl)phenyl]methanamine
CID 63152526
2-(4-butylphenyl)-4-phenyl-1,3-oxazole
CID 56669361
2-(3-fluorophenyl)-N-[4-(4-phenyl-1,3-oxazol-2-yl)phenyl]acetamide
CID 50835517
2-phenyl-4-thiophen-3-yl-1,3-oxazole
CID 119082929
5-[3-(aminomethyl)phenyl]-1,2,4-oxadiazol-3-amine
CID 65417709
4-(2-phenyl-1,3-oxazol-4-yl)benzonitrile
CID 58119309

Frequently Asked Questions

What is the IUPAC name of [3-(2-phenyl-1,3-oxazol-4-yl)phenyl]methanamine?
The IUPAC name of [3-(2-phenyl-1,3-oxazol-4-yl)phenyl]methanamine (CID 115046706) is [3-(2-phenyl-1,3-oxazol-4-yl)phenyl]methanamine.
What is the SMILES notation for [3-(2-phenyl-1,3-oxazol-4-yl)phenyl]methanamine?
The canonical SMILES for [3-(2-phenyl-1,3-oxazol-4-yl)phenyl]methanamine is NCc1cccc(-c2coc(-c3ccccc3)n2)c1.
What is the InChIKey of [3-(2-phenyl-1,3-oxazol-4-yl)phenyl]methanamine?
The InChIKey is UKIXZYOTYGOJIX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14N2O/c17-10-12-5-4-8-14(9-12)15-11-19-16(18-15)13-6-2-1-3-7-13/h1-9,11H,10,17H2.
What are the key properties of [3-(2-phenyl-1,3-oxazol-4-yl)phenyl]methanamine?
[3-(2-phenyl-1,3-oxazol-4-yl)phenyl]methanamine has a molecular weight of 250.30 g/mol, XLogP of 3.47, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(2-phenyl-1,3-oxazol-4-yl)phenyl]methanamine is sourced from PubChem (CID 115046706), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).