5-chloro-6-(5,5-dimethyl-4H-1,3-oxazol-2-yl)pyridin-3-amine

C10H12ClN3O — CID 156539677

IUPAC5-chloro-6-(5,5-dimethyl-4H-1,3-oxazol-2-yl)pyridin-3-amine
SMILESCC1(C)CN=C(c2ncc(N)cc2Cl)O1
InChIInChI=1S/C10H12ClN3O/c1-10(2)5-14-9(15-10)8-7(11)3-6(12)4-13-8/h3-4H,5,12H2,1-2H3
InChIKeyAJLQYWXYBSBLQJ-UHFFFAOYSA-N
MW225.68 g/mol
LogP1.87
Rot. Bonds1

About 5-chloro-6-(5,5-dimethyl-4H-1,3-oxazol-2-yl)pyridin-3-amine

5-chloro-6-(5,5-dimethyl-4H-1,3-oxazol-2-yl)pyridin-3-amine (PubChem CID 156539677) has the molecular formula C10H12ClN3O and a molecular weight of 225.68 g/mol. Its IUPAC name is 5-chloro-6-(5,5-dimethyl-4H-1,3-oxazol-2-yl)pyridin-3-amine.

Molecular Properties

Compound Name5-chloro-6-(5,5-dimethyl-4H-1,3-oxazol-2-yl)pyridin-3-amine
PubChem CID156539677
Molecular FormulaC10H12ClN3O
Molecular Weight225.68 g/mol
Exact Mass225.07
IUPAC Name5-chloro-6-(5,5-dimethyl-4H-1,3-oxazol-2-yl)pyridin-3-amine
SMILESCC1(C)CN=C(c2ncc(N)cc2Cl)O1
InChIInChI=1S/C10H12ClN3O/c1-10(2)5-14-9(15-10)8-7(11)3-6(12)4-13-8/h3-4H,5,12H2,1-2H3
InChIKeyAJLQYWXYBSBLQJ-UHFFFAOYSA-N
XLogP1.87
TPSA60.50 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.68
LogP ≤ 51.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-chloro-6-(5,5-dimethyl-4H-1,3-oxazol-2-yl)pyridin-3-amine?
The IUPAC name of 5-chloro-6-(5,5-dimethyl-4H-1,3-oxazol-2-yl)pyridin-3-amine (CID 156539677) is 5-chloro-6-(5,5-dimethyl-4H-1,3-oxazol-2-yl)pyridin-3-amine.
What is the SMILES notation for 5-chloro-6-(5,5-dimethyl-4H-1,3-oxazol-2-yl)pyridin-3-amine?
The canonical SMILES for 5-chloro-6-(5,5-dimethyl-4H-1,3-oxazol-2-yl)pyridin-3-amine is CC1(C)CN=C(c2ncc(N)cc2Cl)O1.
What is the InChIKey of 5-chloro-6-(5,5-dimethyl-4H-1,3-oxazol-2-yl)pyridin-3-amine?
The InChIKey is AJLQYWXYBSBLQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12ClN3O/c1-10(2)5-14-9(15-10)8-7(11)3-6(12)4-13-8/h3-4H,5,12H2,1-2H3.
What are the key properties of 5-chloro-6-(5,5-dimethyl-4H-1,3-oxazol-2-yl)pyridin-3-amine?
5-chloro-6-(5,5-dimethyl-4H-1,3-oxazol-2-yl)pyridin-3-amine has a molecular weight of 225.68 g/mol, XLogP of 1.87, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-6-(5,5-dimethyl-4H-1,3-oxazol-2-yl)pyridin-3-amine is sourced from PubChem (CID 156539677), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).