3-(2-pyridin-4-yl-1,3-oxazol-4-yl)propan-1-amine

C11H13N3O — CID 115084817

IUPAC3-(2-pyridin-4-yl-1,3-oxazol-4-yl)propan-1-amine
SMILESNCCCc1coc(-c2ccncc2)n1
InChIInChI=1S/C11H13N3O/c12-5-1-2-10-8-15-11(14-10)9-3-6-13-7-4-9/h3-4,6-8H,1-2,5,12H2
InChIKeyYMTVOKKNOYNJIF-UHFFFAOYSA-N
MW203.25 g/mol
LogP1.63
Rot. Bonds4

About 3-(2-pyridin-4-yl-1,3-oxazol-4-yl)propan-1-amine

3-(2-pyridin-4-yl-1,3-oxazol-4-yl)propan-1-amine (PubChem CID 115084817) has the molecular formula C11H13N3O and a molecular weight of 203.25 g/mol. Its IUPAC name is 3-(2-pyridin-4-yl-1,3-oxazol-4-yl)propan-1-amine.

Molecular Properties

Compound Name3-(2-pyridin-4-yl-1,3-oxazol-4-yl)propan-1-amine
PubChem CID115084817
Molecular FormulaC11H13N3O
Molecular Weight203.25 g/mol
Exact Mass203.11
IUPAC Name3-(2-pyridin-4-yl-1,3-oxazol-4-yl)propan-1-amine
SMILESNCCCc1coc(-c2ccncc2)n1
InChIInChI=1S/C11H13N3O/c12-5-1-2-10-8-15-11(14-10)9-3-6-13-7-4-9/h3-4,6-8H,1-2,5,12H2
InChIKeyYMTVOKKNOYNJIF-UHFFFAOYSA-N
XLogP1.63
TPSA64.94 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.25
LogP ≤ 51.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 3-(2-pyridin-4-yl-1,3-oxazol-4-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

3-[2-(3-chlorophenyl)-1,3-oxazol-4-yl]propan-1-amine
CID 115084368
2-[2-(4-methylphenyl)-1,3-oxazol-4-yl]ethanamine
CID 25324136
(2-pyridin-3-yl-1,3-oxazol-4-yl)methanamine
CID 82125165
2-[2-(4-chlorophenyl)-1,3-oxazol-4-yl]acetonitrile;2-[2-(4-chlorophenyl)-1,3-oxazol-4-yl]ethanamine
CID 159604704
3-(2-pyridin-4-yl-1,3-benzoxazol-5-yl)propan-1-amine
CID 82298467
3-[4-(2-aminoethyl)-1,3-oxazol-2-yl]phenol
CID 115084355
2-phenyl-4-propyl-1,3-oxazole
CID 23537835
3-(2-propyl-1,3-oxazol-4-yl)propan-1-amine
CID 115084229
4-hept-6-ynyl-2-phenyl-1,3-oxazole
CID 142811788
4-(isocyanomethyl)-2-(4-methoxyphenyl)-1,3-oxazole;2-[2-(4-methoxyphenyl)-1,3-oxazol-4-yl]ethanamine
CID 160657238
3-(4-furo[3,2-c]pyridin-3-yl-2-pyridinyl)propan-1-amine
CID 82381934
3-(2-pyridin-4-yl-1,3-thiazol-5-yl)propan-1-amine
CID 115092126

Frequently Asked Questions

What is the IUPAC name of 3-(2-pyridin-4-yl-1,3-oxazol-4-yl)propan-1-amine?
The IUPAC name of 3-(2-pyridin-4-yl-1,3-oxazol-4-yl)propan-1-amine (CID 115084817) is 3-(2-pyridin-4-yl-1,3-oxazol-4-yl)propan-1-amine.
What is the SMILES notation for 3-(2-pyridin-4-yl-1,3-oxazol-4-yl)propan-1-amine?
The canonical SMILES for 3-(2-pyridin-4-yl-1,3-oxazol-4-yl)propan-1-amine is NCCCc1coc(-c2ccncc2)n1.
What is the InChIKey of 3-(2-pyridin-4-yl-1,3-oxazol-4-yl)propan-1-amine?
The InChIKey is YMTVOKKNOYNJIF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13N3O/c12-5-1-2-10-8-15-11(14-10)9-3-6-13-7-4-9/h3-4,6-8H,1-2,5,12H2.
What are the key properties of 3-(2-pyridin-4-yl-1,3-oxazol-4-yl)propan-1-amine?
3-(2-pyridin-4-yl-1,3-oxazol-4-yl)propan-1-amine has a molecular weight of 203.25 g/mol, XLogP of 1.63, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-pyridin-4-yl-1,3-oxazol-4-yl)propan-1-amine is sourced from PubChem (CID 115084817), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).