5-methoxy-2-methyl-N-(1,2-oxazol-3-ylmethyl)pyridin-4-amine

C11H13N3O2 — CID 106660618

IUPAC5-methoxy-2-methyl-N-(1,2-oxazol-3-ylmethyl)pyridin-4-amine
SMILESCOc1cnc(C)cc1NCc1ccon1
InChIInChI=1S/C11H13N3O2/c1-8-5-10(11(15-2)7-12-8)13-6-9-3-4-16-14-9/h3-5,7H,6H2,1-2H3,(H,12,13)
InChIKeyKWNCKQPBJHADMZ-UHFFFAOYSA-N
MW219.24 g/mol
LogP2.00
Rot. Bonds4

About 5-methoxy-2-methyl-N-(1,2-oxazol-3-ylmethyl)pyridin-4-amine

5-methoxy-2-methyl-N-(1,2-oxazol-3-ylmethyl)pyridin-4-amine (PubChem CID 106660618) has the molecular formula C11H13N3O2 and a molecular weight of 219.24 g/mol. Its IUPAC name is 5-methoxy-2-methyl-N-(1,2-oxazol-3-ylmethyl)pyridin-4-amine.

Molecular Properties

Compound Name5-methoxy-2-methyl-N-(1,2-oxazol-3-ylmethyl)pyridin-4-amine
PubChem CID106660618
Molecular FormulaC11H13N3O2
Molecular Weight219.24 g/mol
Exact Mass219.10
IUPAC Name5-methoxy-2-methyl-N-(1,2-oxazol-3-ylmethyl)pyridin-4-amine
SMILESCOc1cnc(C)cc1NCc1ccon1
InChIInChI=1S/C11H13N3O2/c1-8-5-10(11(15-2)7-12-8)13-6-9-3-4-16-14-9/h3-5,7H,6H2,1-2H3,(H,12,13)
InChIKeyKWNCKQPBJHADMZ-UHFFFAOYSA-N
XLogP2.00
TPSA60.18 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.24
LogP ≤ 52.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-methoxy-2-methyl-N-(1,2-oxazol-3-ylmethyl)pyridin-4-amine?
The IUPAC name of 5-methoxy-2-methyl-N-(1,2-oxazol-3-ylmethyl)pyridin-4-amine (CID 106660618) is 5-methoxy-2-methyl-N-(1,2-oxazol-3-ylmethyl)pyridin-4-amine.
What is the SMILES notation for 5-methoxy-2-methyl-N-(1,2-oxazol-3-ylmethyl)pyridin-4-amine?
The canonical SMILES for 5-methoxy-2-methyl-N-(1,2-oxazol-3-ylmethyl)pyridin-4-amine is COc1cnc(C)cc1NCc1ccon1.
What is the InChIKey of 5-methoxy-2-methyl-N-(1,2-oxazol-3-ylmethyl)pyridin-4-amine?
The InChIKey is KWNCKQPBJHADMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13N3O2/c1-8-5-10(11(15-2)7-12-8)13-6-9-3-4-16-14-9/h3-5,7H,6H2,1-2H3,(H,12,13).
What are the key properties of 5-methoxy-2-methyl-N-(1,2-oxazol-3-ylmethyl)pyridin-4-amine?
5-methoxy-2-methyl-N-(1,2-oxazol-3-ylmethyl)pyridin-4-amine has a molecular weight of 219.24 g/mol, XLogP of 2.00, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methoxy-2-methyl-N-(1,2-oxazol-3-ylmethyl)pyridin-4-amine is sourced from PubChem (CID 106660618), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).