3-methyl-2,6-dihydro-1,3-oxazin-6-amine

C5H10N2O — CID 118136553

IUPAC3-methyl-2,6-dihydro-1,3-oxazin-6-amine
SMILESCN1C=CC(N)OC1
InChIInChI=1S/C5H10N2O/c1-7-3-2-5(6)8-4-7/h2-3,5H,4,6H2,1H3
InChIKeyPJQOTZCESMDNCV-UHFFFAOYSA-N
MW114.15 g/mol
LogP-0.30
Rot. Bonds

About 3-methyl-2,6-dihydro-1,3-oxazin-6-amine

3-methyl-2,6-dihydro-1,3-oxazin-6-amine (PubChem CID 118136553) has the molecular formula C5H10N2O and a molecular weight of 114.15 g/mol. Its IUPAC name is 3-methyl-2,6-dihydro-1,3-oxazin-6-amine.

Molecular Properties

Compound Name3-methyl-2,6-dihydro-1,3-oxazin-6-amine
PubChem CID118136553
Molecular FormulaC5H10N2O
Molecular Weight114.15 g/mol
Exact Mass114.08
IUPAC Name3-methyl-2,6-dihydro-1,3-oxazin-6-amine
SMILESCN1C=CC(N)OC1
InChIInChI=1S/C5H10N2O/c1-7-3-2-5(6)8-4-7/h2-3,5H,4,6H2,1H3
InChIKeyPJQOTZCESMDNCV-UHFFFAOYSA-N
XLogP-0.30
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500114.15
LogP ≤ 5-0.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-methyl-2,6-dihydro-1,3-oxazin-6-amine?
The IUPAC name of 3-methyl-2,6-dihydro-1,3-oxazin-6-amine (CID 118136553) is 3-methyl-2,6-dihydro-1,3-oxazin-6-amine.
What is the SMILES notation for 3-methyl-2,6-dihydro-1,3-oxazin-6-amine?
The canonical SMILES for 3-methyl-2,6-dihydro-1,3-oxazin-6-amine is CN1C=CC(N)OC1.
What is the InChIKey of 3-methyl-2,6-dihydro-1,3-oxazin-6-amine?
The InChIKey is PJQOTZCESMDNCV-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H10N2O/c1-7-3-2-5(6)8-4-7/h2-3,5H,4,6H2,1H3.
What are the key properties of 3-methyl-2,6-dihydro-1,3-oxazin-6-amine?
3-methyl-2,6-dihydro-1,3-oxazin-6-amine has a molecular weight of 114.15 g/mol, XLogP of -0.30, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-2,6-dihydro-1,3-oxazin-6-amine is sourced from PubChem (CID 118136553), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).