1-[3-(4-methyl-3-pyridinyl)-1,2-oxazol-5-yl]propan-1-amine

C12H15N3O — CID 106223961

IUPAC1-[3-(4-methyl-3-pyridinyl)-1,2-oxazol-5-yl]propan-1-amine
SMILESCCC(N)c1cc(-c2cnccc2C)no1
InChIInChI=1S/C12H15N3O/c1-3-10(13)12-6-11(15-16-12)9-7-14-5-4-8(9)2/h4-7,10H,3,13H2,1-2H3
InChIKeyOBSHSURIXLQVKW-UHFFFAOYSA-N
MW217.27 g/mol
LogP2.45
Rot. Bonds3

About 1-[3-(4-methyl-3-pyridinyl)-1,2-oxazol-5-yl]propan-1-amine

1-[3-(4-methyl-3-pyridinyl)-1,2-oxazol-5-yl]propan-1-amine (PubChem CID 106223961) has the molecular formula C12H15N3O and a molecular weight of 217.27 g/mol. Its IUPAC name is 1-[3-(4-methyl-3-pyridinyl)-1,2-oxazol-5-yl]propan-1-amine.

Molecular Properties

Compound Name1-[3-(4-methyl-3-pyridinyl)-1,2-oxazol-5-yl]propan-1-amine
PubChem CID106223961
Molecular FormulaC12H15N3O
Molecular Weight217.27 g/mol
Exact Mass217.12
IUPAC Name1-[3-(4-methyl-3-pyridinyl)-1,2-oxazol-5-yl]propan-1-amine
SMILESCCC(N)c1cc(-c2cnccc2C)no1
InChIInChI=1S/C12H15N3O/c1-3-10(13)12-6-11(15-16-12)9-7-14-5-4-8(9)2/h4-7,10H,3,13H2,1-2H3
InChIKeyOBSHSURIXLQVKW-UHFFFAOYSA-N
XLogP2.45
TPSA64.94 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.27
LogP ≤ 52.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 1-[3-(4-methyl-3-pyridinyl)-1,2-oxazol-5-yl]propan-1-amine 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

1-[3-(2,4,6-trimethylphenyl)-1,2-oxazol-5-yl]propan-1-amine
CID 114160439
1-[3-[2-(trifluoromethyl)phenyl]-1,2-oxazol-5-yl]propan-1-amine
CID 106223997
1-[3-(2,3,4-trimethoxyphenyl)-1,2-oxazol-5-yl]propan-1-amine
CID 106223852
1-[3-(3,5-difluorophenyl)-1,2-oxazol-5-yl]propan-1-amine
CID 106224117
1-[3-[4-(trifluoromethyl)phenyl]-1,2-oxazol-5-yl]propan-1-amine
CID 106224091
1-[3-(1-propan-2-ylpyrazol-4-yl)-1,2-oxazol-5-yl]propan-1-amine
CID 106223965
1-[3-(4-methyl-3-pyridinyl)-1,2,4-oxadiazol-5-yl]-3-methylsulfanylpropan-1-amine
CID 114876517
1-[3-(4-fluoro-3-methylphenyl)-1,2-oxazol-5-yl]butan-1-amine
CID 106224128
3-[3-(4-methyl-3-pyridinyl)-1,2,4-oxadiazol-5-yl]pentan-3-amine
CID 114877100
7-(4-methyl-3-pyridinyl)-2,6-naphthyridin-3-amine
CID 71115051
2-[3-(4-methyl-3-pyridinyl)-1,2,4-oxadiazol-5-yl]-1-phenylethanamine
CID 114876703
1-[3-(5-bromo-2-fluorophenyl)-1,2-oxazol-5-yl]butan-1-amine
CID 114160485

Frequently Asked Questions

What is the IUPAC name of 1-[3-(4-methyl-3-pyridinyl)-1,2-oxazol-5-yl]propan-1-amine?
The IUPAC name of 1-[3-(4-methyl-3-pyridinyl)-1,2-oxazol-5-yl]propan-1-amine (CID 106223961) is 1-[3-(4-methyl-3-pyridinyl)-1,2-oxazol-5-yl]propan-1-amine.
What is the SMILES notation for 1-[3-(4-methyl-3-pyridinyl)-1,2-oxazol-5-yl]propan-1-amine?
The canonical SMILES for 1-[3-(4-methyl-3-pyridinyl)-1,2-oxazol-5-yl]propan-1-amine is CCC(N)c1cc(-c2cnccc2C)no1.
What is the InChIKey of 1-[3-(4-methyl-3-pyridinyl)-1,2-oxazol-5-yl]propan-1-amine?
The InChIKey is OBSHSURIXLQVKW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N3O/c1-3-10(13)12-6-11(15-16-12)9-7-14-5-4-8(9)2/h4-7,10H,3,13H2,1-2H3.
What are the key properties of 1-[3-(4-methyl-3-pyridinyl)-1,2-oxazol-5-yl]propan-1-amine?
1-[3-(4-methyl-3-pyridinyl)-1,2-oxazol-5-yl]propan-1-amine has a molecular weight of 217.27 g/mol, XLogP of 2.45, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-(4-methyl-3-pyridinyl)-1,2-oxazol-5-yl]propan-1-amine is sourced from PubChem (CID 106223961), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).