1-([1,3]oxazolo[4,5-b]pyridin-2-yl)pyrrolidin-3-amine

C10H12N4O — CID 43831644

IUPAC1-([1,3]oxazolo[4,5-b]pyridin-2-yl)pyrrolidin-3-amine
SMILESNC1CCN(c2nc3ncccc3o2)C1
InChIInChI=1S/C10H12N4O/c11-7-3-5-14(6-7)10-13-9-8(15-10)2-1-4-12-9/h1-2,4,7H,3,5-6,11H2
InChIKeyLXCGGKLZKWRYJH-UHFFFAOYSA-N
MW204.23 g/mol
LogP0.76
Rot. Bonds1

About 1-([1,3]oxazolo[4,5-b]pyridin-2-yl)pyrrolidin-3-amine

1-([1,3]oxazolo[4,5-b]pyridin-2-yl)pyrrolidin-3-amine (PubChem CID 43831644) has the molecular formula C10H12N4O and a molecular weight of 204.23 g/mol. Its IUPAC name is 1-([1,3]oxazolo[4,5-b]pyridin-2-yl)pyrrolidin-3-amine.

Molecular Properties

Compound Name1-([1,3]oxazolo[4,5-b]pyridin-2-yl)pyrrolidin-3-amine
PubChem CID43831644
Molecular FormulaC10H12N4O
Molecular Weight204.23 g/mol
Exact Mass204.10
IUPAC Name1-([1,3]oxazolo[4,5-b]pyridin-2-yl)pyrrolidin-3-amine
SMILESNC1CCN(c2nc3ncccc3o2)C1
InChIInChI=1S/C10H12N4O/c11-7-3-5-14(6-7)10-13-9-8(15-10)2-1-4-12-9/h1-2,4,7H,3,5-6,11H2
InChIKeyLXCGGKLZKWRYJH-UHFFFAOYSA-N
XLogP0.76
TPSA68.18 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.23
LogP ≤ 50.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-([1,3]oxazolo[4,5-b]pyridin-2-yl)pyrrolidin-3-amine?
The IUPAC name of 1-([1,3]oxazolo[4,5-b]pyridin-2-yl)pyrrolidin-3-amine (CID 43831644) is 1-([1,3]oxazolo[4,5-b]pyridin-2-yl)pyrrolidin-3-amine.
What is the SMILES notation for 1-([1,3]oxazolo[4,5-b]pyridin-2-yl)pyrrolidin-3-amine?
The canonical SMILES for 1-([1,3]oxazolo[4,5-b]pyridin-2-yl)pyrrolidin-3-amine is NC1CCN(c2nc3ncccc3o2)C1.
What is the InChIKey of 1-([1,3]oxazolo[4,5-b]pyridin-2-yl)pyrrolidin-3-amine?
The InChIKey is LXCGGKLZKWRYJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N4O/c11-7-3-5-14(6-7)10-13-9-8(15-10)2-1-4-12-9/h1-2,4,7H,3,5-6,11H2.
What are the key properties of 1-([1,3]oxazolo[4,5-b]pyridin-2-yl)pyrrolidin-3-amine?
1-([1,3]oxazolo[4,5-b]pyridin-2-yl)pyrrolidin-3-amine has a molecular weight of 204.23 g/mol, XLogP of 0.76, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-([1,3]oxazolo[4,5-b]pyridin-2-yl)pyrrolidin-3-amine is sourced from PubChem (CID 43831644), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).