1-(6-chloro-[1,3]oxazolo[5,4-b]pyridin-2-yl)propan-2-amine

C9H10ClN3O — CID 83885653

IUPAC1-(6-chloro-[1,3]oxazolo[5,4-b]pyridin-2-yl)propan-2-amine
SMILESCC(N)Cc1nc2cc(Cl)cnc2o1
InChIInChI=1S/C9H10ClN3O/c1-5(11)2-8-13-7-3-6(10)4-12-9(7)14-8/h3-5H,2,11H2,1H3
InChIKeyOLYSFIXTRSONTI-UHFFFAOYSA-N
MW211.65 g/mol
LogP1.77
Rot. Bonds2

About 1-(6-chloro-[1,3]oxazolo[5,4-b]pyridin-2-yl)propan-2-amine

1-(6-chloro-[1,3]oxazolo[5,4-b]pyridin-2-yl)propan-2-amine (PubChem CID 83885653) has the molecular formula C9H10ClN3O and a molecular weight of 211.65 g/mol. Its IUPAC name is 1-(6-chloro-[1,3]oxazolo[5,4-b]pyridin-2-yl)propan-2-amine.

Molecular Properties

Compound Name1-(6-chloro-[1,3]oxazolo[5,4-b]pyridin-2-yl)propan-2-amine
PubChem CID83885653
Molecular FormulaC9H10ClN3O
Molecular Weight211.65 g/mol
Exact Mass211.05
IUPAC Name1-(6-chloro-[1,3]oxazolo[5,4-b]pyridin-2-yl)propan-2-amine
SMILESCC(N)Cc1nc2cc(Cl)cnc2o1
InChIInChI=1S/C9H10ClN3O/c1-5(11)2-8-13-7-3-6(10)4-12-9(7)14-8/h3-5H,2,11H2,1H3
InChIKeyOLYSFIXTRSONTI-UHFFFAOYSA-N
XLogP1.77
TPSA64.94 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.65
LogP ≤ 51.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-(6-chloro-[1,3]oxazolo[5,4-b]pyridin-2-yl)propanoic acid
CID 83892643
1-(1,3-benzoxazol-2-yl)propan-2-amine;ethane
CID 142930322
(2-ethyl-[1,3]oxazolo[5,4-b]pyridin-6-yl)methanamine
CID 84655981
3-(5,7-dichloro-1,3-benzoxazol-2-yl)-2-methylpropan-1-amine
CID 107676406
6-chloro-[1,3]oxazolo[5,4-b]pyridine
CID 55252688
1-(1,2,4-oxadiazol-5-yl)propan-2-amine
CID 82234832
1-(2-methyl-[1,3]oxazolo[5,4-b]pyridin-6-yl)ethanamine
CID 84655967
5-chloro-2-(2-methylpropyl)-[1,3]oxazolo[5,4-b]pyridine
CID 84678071
6-chloro-2-[4-(trifluoromethyl)phenyl]-[1,3]oxazolo[5,4-b]pyridine
CID 82337728
3-(2-amino-5-chloro-3-pyridinyl)-2-methylpropan-1-ol
CID 64666699
6-chloro-2-(3,4-dimethoxyphenyl)-[1,3]oxazolo[5,4-b]pyridine
CID 82337691
3-(6-chloro-1,3-benzoxazol-2-yl)-2-methylpropan-1-amine
CID 81434041

Frequently Asked Questions

What is the IUPAC name of 1-(6-chloro-[1,3]oxazolo[5,4-b]pyridin-2-yl)propan-2-amine?
The IUPAC name of 1-(6-chloro-[1,3]oxazolo[5,4-b]pyridin-2-yl)propan-2-amine (CID 83885653) is 1-(6-chloro-[1,3]oxazolo[5,4-b]pyridin-2-yl)propan-2-amine.
What is the SMILES notation for 1-(6-chloro-[1,3]oxazolo[5,4-b]pyridin-2-yl)propan-2-amine?
The canonical SMILES for 1-(6-chloro-[1,3]oxazolo[5,4-b]pyridin-2-yl)propan-2-amine is CC(N)Cc1nc2cc(Cl)cnc2o1.
What is the InChIKey of 1-(6-chloro-[1,3]oxazolo[5,4-b]pyridin-2-yl)propan-2-amine?
The InChIKey is OLYSFIXTRSONTI-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10ClN3O/c1-5(11)2-8-13-7-3-6(10)4-12-9(7)14-8/h3-5H,2,11H2,1H3.
What are the key properties of 1-(6-chloro-[1,3]oxazolo[5,4-b]pyridin-2-yl)propan-2-amine?
1-(6-chloro-[1,3]oxazolo[5,4-b]pyridin-2-yl)propan-2-amine has a molecular weight of 211.65 g/mol, XLogP of 1.77, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(6-chloro-[1,3]oxazolo[5,4-b]pyridin-2-yl)propan-2-amine is sourced from PubChem (CID 83885653), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).