2,4-dimethyl-2,3-dihydropyrido[4,3-b][1,4]oxazin-8-amine

C9H13N3O — CID 171622735

IUPAC2,4-dimethyl-2,3-dihydropyrido[4,3-b][1,4]oxazin-8-amine
SMILESCC1CN(C)c2cncc(N)c2O1
InChIInChI=1S/C9H13N3O/c1-6-5-12(2)8-4-11-3-7(10)9(8)13-6/h3-4,6H,5,10H2,1-2H3
InChIKeyVIABIZQHMIUHKQ-UHFFFAOYSA-N
MW179.22 g/mol
LogP0.88
Rot. Bonds

About 2,4-dimethyl-2,3-dihydropyrido[4,3-b][1,4]oxazin-8-amine

2,4-dimethyl-2,3-dihydropyrido[4,3-b][1,4]oxazin-8-amine (PubChem CID 171622735) has the molecular formula C9H13N3O and a molecular weight of 179.22 g/mol. Its IUPAC name is 2,4-dimethyl-2,3-dihydropyrido[4,3-b][1,4]oxazin-8-amine.

Molecular Properties

Compound Name2,4-dimethyl-2,3-dihydropyrido[4,3-b][1,4]oxazin-8-amine
PubChem CID171622735
Molecular FormulaC9H13N3O
Molecular Weight179.22 g/mol
Exact Mass179.11
IUPAC Name2,4-dimethyl-2,3-dihydropyrido[4,3-b][1,4]oxazin-8-amine
SMILESCC1CN(C)c2cncc(N)c2O1
InChIInChI=1S/C9H13N3O/c1-6-5-12(2)8-4-11-3-7(10)9(8)13-6/h3-4,6H,5,10H2,1-2H3
InChIKeyVIABIZQHMIUHKQ-UHFFFAOYSA-N
XLogP0.88
TPSA51.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.22
LogP ≤ 50.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2,4-dimethyl-2,3-dihydropyrido[4,3-b][1,4]oxazin-8-amine?
The IUPAC name of 2,4-dimethyl-2,3-dihydropyrido[4,3-b][1,4]oxazin-8-amine (CID 171622735) is 2,4-dimethyl-2,3-dihydropyrido[4,3-b][1,4]oxazin-8-amine.
What is the SMILES notation for 2,4-dimethyl-2,3-dihydropyrido[4,3-b][1,4]oxazin-8-amine?
The canonical SMILES for 2,4-dimethyl-2,3-dihydropyrido[4,3-b][1,4]oxazin-8-amine is CC1CN(C)c2cncc(N)c2O1.
What is the InChIKey of 2,4-dimethyl-2,3-dihydropyrido[4,3-b][1,4]oxazin-8-amine?
The InChIKey is VIABIZQHMIUHKQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13N3O/c1-6-5-12(2)8-4-11-3-7(10)9(8)13-6/h3-4,6H,5,10H2,1-2H3.
What are the key properties of 2,4-dimethyl-2,3-dihydropyrido[4,3-b][1,4]oxazin-8-amine?
2,4-dimethyl-2,3-dihydropyrido[4,3-b][1,4]oxazin-8-amine has a molecular weight of 179.22 g/mol, XLogP of 0.88, 0 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dimethyl-2,3-dihydropyrido[4,3-b][1,4]oxazin-8-amine is sourced from PubChem (CID 171622735), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).