2-(2-phenyl-1,3-oxazol-5-yl)propan-1-amine

C12H14N2O — CID 115087133

IUPAC2-(2-phenyl-1,3-oxazol-5-yl)propan-1-amine
SMILESCC(CN)c1cnc(-c2ccccc2)o1
InChIInChI=1S/C12H14N2O/c1-9(7-13)11-8-14-12(15-11)10-5-3-2-4-6-10/h2-6,8-9H,7,13H2,1H3
InChIKeyUWBJVIHJWGTENI-UHFFFAOYSA-N
MW202.26 g/mol
LogP2.40
Rot. Bonds3

About 2-(2-phenyl-1,3-oxazol-5-yl)propan-1-amine

2-(2-phenyl-1,3-oxazol-5-yl)propan-1-amine (PubChem CID 115087133) has the molecular formula C12H14N2O and a molecular weight of 202.26 g/mol. Its IUPAC name is 2-(2-phenyl-1,3-oxazol-5-yl)propan-1-amine.

Molecular Properties

Compound Name2-(2-phenyl-1,3-oxazol-5-yl)propan-1-amine
PubChem CID115087133
Molecular FormulaC12H14N2O
Molecular Weight202.26 g/mol
Exact Mass202.11
IUPAC Name2-(2-phenyl-1,3-oxazol-5-yl)propan-1-amine
SMILESCC(CN)c1cnc(-c2ccccc2)o1
InChIInChI=1S/C12H14N2O/c1-9(7-13)11-8-14-12(15-11)10-5-3-2-4-6-10/h2-6,8-9H,7,13H2,1H3
InChIKeyUWBJVIHJWGTENI-UHFFFAOYSA-N
XLogP2.40
TPSA52.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.26
LogP ≤ 52.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(2-phenyl-1,3-oxazol-5-yl)ethanol
CID 115087081
5-(dimethoxymethyl)-2-phenyl-1,3-oxazole
CID 177437797
(R)-2-methyl-N-[(1R)-1-(2-phenyl-1,3-oxazol-5-yl)ethyl]propane-2-sulfinamide
CID 170789384
2-(4-phenylphenyl)-5-(4-propan-2-ylphenyl)-1,3-oxazole
CID 71327926
5-(4-methylphenyl)-2-phenyl-1,3-oxazole
CID 3946772
(1S)-3-methyl-1-(5-phenyl-1,3-oxazol-2-yl)butan-1-amine;sulfane
CID 161178704
N-butan-2-yl-4-(5-phenyl-1,3-oxazol-2-yl)benzenesulfonamide
CID 19258693
1-[2-(3-methylphenyl)-1,3-oxazol-5-yl]ethanol
CID 115087082
5-[(2-methylphenyl)methyl]-2-phenyl-1,3-oxazole
CID 11414009
2-(2-cyclohexyl-1,3-oxazol-5-yl)propan-1-amine
CID 115087448
N-methyl-N,2-diphenyl-1,3-oxazol-5-amine
CID 575782
2-phenyl-1,3-oxazole-5-carbonitrile
CID 130055318

Frequently Asked Questions

What is the IUPAC name of 2-(2-phenyl-1,3-oxazol-5-yl)propan-1-amine?
The IUPAC name of 2-(2-phenyl-1,3-oxazol-5-yl)propan-1-amine (CID 115087133) is 2-(2-phenyl-1,3-oxazol-5-yl)propan-1-amine.
What is the SMILES notation for 2-(2-phenyl-1,3-oxazol-5-yl)propan-1-amine?
The canonical SMILES for 2-(2-phenyl-1,3-oxazol-5-yl)propan-1-amine is CC(CN)c1cnc(-c2ccccc2)o1.
What is the InChIKey of 2-(2-phenyl-1,3-oxazol-5-yl)propan-1-amine?
The InChIKey is UWBJVIHJWGTENI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N2O/c1-9(7-13)11-8-14-12(15-11)10-5-3-2-4-6-10/h2-6,8-9H,7,13H2,1H3.
What are the key properties of 2-(2-phenyl-1,3-oxazol-5-yl)propan-1-amine?
2-(2-phenyl-1,3-oxazol-5-yl)propan-1-amine has a molecular weight of 202.26 g/mol, XLogP of 2.40, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-phenyl-1,3-oxazol-5-yl)propan-1-amine is sourced from PubChem (CID 115087133), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).