(2-cyclopentyl-[1,3]oxazolo[4,5-b]pyridin-7-yl)methanamine

C12H15N3O — CID 84682820

IUPAC(2-cyclopentyl-[1,3]oxazolo[4,5-b]pyridin-7-yl)methanamine
SMILESNCc1ccnc2nc(C3CCCC3)oc12
InChIInChI=1S/C12H15N3O/c13-7-9-5-6-14-11-10(9)16-12(15-11)8-3-1-2-4-8/h5-6,8H,1-4,7,13H2
InChIKeyKRNNGHQPZBFKGE-UHFFFAOYSA-N
MW217.27 g/mol
LogP2.34
Rot. Bonds2

About (2-cyclopentyl-[1,3]oxazolo[4,5-b]pyridin-7-yl)methanamine

(2-cyclopentyl-[1,3]oxazolo[4,5-b]pyridin-7-yl)methanamine (PubChem CID 84682820) has the molecular formula C12H15N3O and a molecular weight of 217.27 g/mol. Its IUPAC name is (2-cyclopentyl-[1,3]oxazolo[4,5-b]pyridin-7-yl)methanamine.

Molecular Properties

Compound Name(2-cyclopentyl-[1,3]oxazolo[4,5-b]pyridin-7-yl)methanamine
PubChem CID84682820
Molecular FormulaC12H15N3O
Molecular Weight217.27 g/mol
Exact Mass217.12
IUPAC Name(2-cyclopentyl-[1,3]oxazolo[4,5-b]pyridin-7-yl)methanamine
SMILESNCc1ccnc2nc(C3CCCC3)oc12
InChIInChI=1S/C12H15N3O/c13-7-9-5-6-14-11-10(9)16-12(15-11)8-3-1-2-4-8/h5-6,8H,1-4,7,13H2
InChIKeyKRNNGHQPZBFKGE-UHFFFAOYSA-N
XLogP2.34
TPSA64.94 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.27
LogP ≤ 52.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze (2-cyclopentyl-[1,3]oxazolo[4,5-b]pyridin-7-yl)methanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (2-cyclopentyl-[1,3]oxazolo[4,5-b]pyridin-7-yl)methanamine?
The IUPAC name of (2-cyclopentyl-[1,3]oxazolo[4,5-b]pyridin-7-yl)methanamine (CID 84682820) is (2-cyclopentyl-[1,3]oxazolo[4,5-b]pyridin-7-yl)methanamine.
What is the SMILES notation for (2-cyclopentyl-[1,3]oxazolo[4,5-b]pyridin-7-yl)methanamine?
The canonical SMILES for (2-cyclopentyl-[1,3]oxazolo[4,5-b]pyridin-7-yl)methanamine is NCc1ccnc2nc(C3CCCC3)oc12.
What is the InChIKey of (2-cyclopentyl-[1,3]oxazolo[4,5-b]pyridin-7-yl)methanamine?
The InChIKey is KRNNGHQPZBFKGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N3O/c13-7-9-5-6-14-11-10(9)16-12(15-11)8-3-1-2-4-8/h5-6,8H,1-4,7,13H2.
What are the key properties of (2-cyclopentyl-[1,3]oxazolo[4,5-b]pyridin-7-yl)methanamine?
(2-cyclopentyl-[1,3]oxazolo[4,5-b]pyridin-7-yl)methanamine has a molecular weight of 217.27 g/mol, XLogP of 2.34, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2-cyclopentyl-[1,3]oxazolo[4,5-b]pyridin-7-yl)methanamine is sourced from PubChem (CID 84682820), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).