6-methyl-3,4-dihydro-2H-cyclohepta[b][1,4]oxazin-6-amine

C10H14N2O — CID 143248770

IUPAC6-methyl-3,4-dihydro-2H-cyclohepta[b][1,4]oxazin-6-amine
SMILESCC1(N)C=CC=C2OCCNC2=C1
InChIInChI=1S/C10H14N2O/c1-10(11)4-2-3-9-8(7-10)12-5-6-13-9/h2-4,7,12H,5-6,11H2,1H3
InChIKeyNQLPDXNOIHPLBH-UHFFFAOYSA-N
MW178.23 g/mol
LogP0.66
Rot. Bonds

About 6-methyl-3,4-dihydro-2H-cyclohepta[b][1,4]oxazin-6-amine

6-methyl-3,4-dihydro-2H-cyclohepta[b][1,4]oxazin-6-amine (PubChem CID 143248770) has the molecular formula C10H14N2O and a molecular weight of 178.23 g/mol. Its IUPAC name is 6-methyl-3,4-dihydro-2H-cyclohepta[b][1,4]oxazin-6-amine.

Molecular Properties

Compound Name6-methyl-3,4-dihydro-2H-cyclohepta[b][1,4]oxazin-6-amine
PubChem CID143248770
Molecular FormulaC10H14N2O
Molecular Weight178.23 g/mol
Exact Mass178.11
IUPAC Name6-methyl-3,4-dihydro-2H-cyclohepta[b][1,4]oxazin-6-amine
SMILESCC1(N)C=CC=C2OCCNC2=C1
InChIInChI=1S/C10H14N2O/c1-10(11)4-2-3-9-8(7-10)12-5-6-13-9/h2-4,7,12H,5-6,11H2,1H3
InChIKeyNQLPDXNOIHPLBH-UHFFFAOYSA-N
XLogP0.66
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.23
LogP ≤ 50.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-methyl-3,4-dihydro-2H-cyclohepta[b][1,4]oxazin-6-amine?
The IUPAC name of 6-methyl-3,4-dihydro-2H-cyclohepta[b][1,4]oxazin-6-amine (CID 143248770) is 6-methyl-3,4-dihydro-2H-cyclohepta[b][1,4]oxazin-6-amine.
What is the SMILES notation for 6-methyl-3,4-dihydro-2H-cyclohepta[b][1,4]oxazin-6-amine?
The canonical SMILES for 6-methyl-3,4-dihydro-2H-cyclohepta[b][1,4]oxazin-6-amine is CC1(N)C=CC=C2OCCNC2=C1.
What is the InChIKey of 6-methyl-3,4-dihydro-2H-cyclohepta[b][1,4]oxazin-6-amine?
The InChIKey is NQLPDXNOIHPLBH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2O/c1-10(11)4-2-3-9-8(7-10)12-5-6-13-9/h2-4,7,12H,5-6,11H2,1H3.
What are the key properties of 6-methyl-3,4-dihydro-2H-cyclohepta[b][1,4]oxazin-6-amine?
6-methyl-3,4-dihydro-2H-cyclohepta[b][1,4]oxazin-6-amine has a molecular weight of 178.23 g/mol, XLogP of 0.66, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-3,4-dihydro-2H-cyclohepta[b][1,4]oxazin-6-amine is sourced from PubChem (CID 143248770), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).