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

C10H12N4O — CID 166803541

IUPAC(3R)-1-([1,3]oxazolo[5,4-b]pyridin-2-yl)pyrrolidin-3-amine
SMILESN[C@@H]1CCN(c2nc3cccnc3o2)C1
InChIInChI=1S/C10H12N4O/c11-7-3-5-14(6-7)10-13-8-2-1-4-12-9(8)15-10/h1-2,4,7H,3,5-6,11H2/t7-/m1/s1
InChIKeyXXLCIFLCKDRQNM-SSDOTTSWSA-N
MW204.23 g/mol
LogP0.76
Rot. Bonds1

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

(3R)-1-([1,3]oxazolo[5,4-b]pyridin-2-yl)pyrrolidin-3-amine (PubChem CID 166803541) has the molecular formula C10H12N4O and a molecular weight of 204.23 g/mol. Its IUPAC name is (3R)-1-([1,3]oxazolo[5,4-b]pyridin-2-yl)pyrrolidin-3-amine.

Molecular Properties

Compound Name(3R)-1-([1,3]oxazolo[5,4-b]pyridin-2-yl)pyrrolidin-3-amine
PubChem CID166803541
Molecular FormulaC10H12N4O
Molecular Weight204.23 g/mol
Exact Mass204.10
IUPAC Name(3R)-1-([1,3]oxazolo[5,4-b]pyridin-2-yl)pyrrolidin-3-amine
SMILESN[C@@H]1CCN(c2nc3cccnc3o2)C1
InChIInChI=1S/C10H12N4O/c11-7-3-5-14(6-7)10-13-8-2-1-4-12-9(8)15-10/h1-2,4,7H,3,5-6,11H2/t7-/m1/s1
InChIKeyXXLCIFLCKDRQNM-SSDOTTSWSA-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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Related Compounds

[1-([1,3]oxazolo[5,4-b]pyridin-2-yl)pyrrolidin-3-yl]methanamine
CID 83836541
1-([1,3]oxazolo[4,5-b]pyridin-2-yl)pyrrolidin-3-amine
CID 43831644
1-(6-chloro-1,3-benzoxazol-2-yl)pyrrolidin-3-amine
CID 83842622
(3R)-1-pyrimidin-2-ylpyrrolidin-3-amine
CID 71643779
1-pyrimidin-2-ylpyrrolidin-3-amine;hydrochloride
CID 71644293
1-(3-methyl-2-pyridinyl)pyrrolidin-3-amine
CID 62253531
(3S)-1-pyridin-2-ylpyrrolidin-3-amine;hydrochloride
CID 71643959
4-[(3S)-3-aminopyrrolidin-1-yl]pyrimidin-2-amine
CID 59631602
1-(1,2,4-benzotriazin-3-yl)pyrrolidin-3-amine
CID 103204643
(3S)-1-quinoxalin-2-ylpyrrolidin-3-amine;hydrochloride
CID 71643977
1-(3-chloro-2-pyridinyl)piperidin-4-amine;hydrochloride
CID 69359259
(3S)-1-(2-chloropyrimidin-4-yl)pyrrolidin-3-amine
CID 71643947

Frequently Asked Questions

What is the IUPAC name of (3R)-1-([1,3]oxazolo[5,4-b]pyridin-2-yl)pyrrolidin-3-amine?
The IUPAC name of (3R)-1-([1,3]oxazolo[5,4-b]pyridin-2-yl)pyrrolidin-3-amine (CID 166803541) is (3R)-1-([1,3]oxazolo[5,4-b]pyridin-2-yl)pyrrolidin-3-amine.
What is the SMILES notation for (3R)-1-([1,3]oxazolo[5,4-b]pyridin-2-yl)pyrrolidin-3-amine?
The canonical SMILES for (3R)-1-([1,3]oxazolo[5,4-b]pyridin-2-yl)pyrrolidin-3-amine is N[C@@H]1CCN(c2nc3cccnc3o2)C1.
What is the InChIKey of (3R)-1-([1,3]oxazolo[5,4-b]pyridin-2-yl)pyrrolidin-3-amine?
The InChIKey is XXLCIFLCKDRQNM-SSDOTTSWSA-N. The full InChI is InChI=1S/C10H12N4O/c11-7-3-5-14(6-7)10-13-8-2-1-4-12-9(8)15-10/h1-2,4,7H,3,5-6,11H2/t7-/m1/s1.
What are the key properties of (3R)-1-([1,3]oxazolo[5,4-b]pyridin-2-yl)pyrrolidin-3-amine?
(3R)-1-([1,3]oxazolo[5,4-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 (3R)-1-([1,3]oxazolo[5,4-b]pyridin-2-yl)pyrrolidin-3-amine is sourced from PubChem (CID 166803541), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).