1,10-dimethyl-3,4-dihydro-1H-[1,4]oxazino[4,3-a]indole

C13H15NO — CID 86733524

IUPAC1,10-dimethyl-3,4-dihydro-1H-[1,4]oxazino[4,3-a]indole
SMILESCc1c2n(c3ccccc13)CCOC2C
InChIInChI=1S/C13H15NO/c1-9-11-5-3-4-6-12(11)14-7-8-15-10(2)13(9)14/h3-6,10H,7-8H2,1-2H3
InChIKeyKRGGCRNSPCOHHY-UHFFFAOYSA-N
MW201.27 g/mol
LogP3.04
Rot. Bonds

About 1,10-dimethyl-3,4-dihydro-1H-[1,4]oxazino[4,3-a]indole

1,10-dimethyl-3,4-dihydro-1H-[1,4]oxazino[4,3-a]indole (PubChem CID 86733524) has the molecular formula C13H15NO and a molecular weight of 201.27 g/mol. Its IUPAC name is 1,10-dimethyl-3,4-dihydro-1H-[1,4]oxazino[4,3-a]indole.

Molecular Properties

Compound Name1,10-dimethyl-3,4-dihydro-1H-[1,4]oxazino[4,3-a]indole
PubChem CID86733524
Molecular FormulaC13H15NO
Molecular Weight201.27 g/mol
Exact Mass201.12
IUPAC Name1,10-dimethyl-3,4-dihydro-1H-[1,4]oxazino[4,3-a]indole
SMILESCc1c2n(c3ccccc13)CCOC2C
InChIInChI=1S/C13H15NO/c1-9-11-5-3-4-6-12(11)14-7-8-15-10(2)13(9)14/h3-6,10H,7-8H2,1-2H3
InChIKeyKRGGCRNSPCOHHY-UHFFFAOYSA-N
XLogP3.04
TPSA14.16 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.27
LogP ≤ 53.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 1,10-dimethyl-3,4-dihydro-1H-[1,4]oxazino[4,3-a]indole with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1,10-dimethyl-3,4-dihydro-1H-[1,4]oxazino[4,3-a]indole?
The IUPAC name of 1,10-dimethyl-3,4-dihydro-1H-[1,4]oxazino[4,3-a]indole (CID 86733524) is 1,10-dimethyl-3,4-dihydro-1H-[1,4]oxazino[4,3-a]indole.
What is the SMILES notation for 1,10-dimethyl-3,4-dihydro-1H-[1,4]oxazino[4,3-a]indole?
The canonical SMILES for 1,10-dimethyl-3,4-dihydro-1H-[1,4]oxazino[4,3-a]indole is Cc1c2n(c3ccccc13)CCOC2C.
What is the InChIKey of 1,10-dimethyl-3,4-dihydro-1H-[1,4]oxazino[4,3-a]indole?
The InChIKey is KRGGCRNSPCOHHY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15NO/c1-9-11-5-3-4-6-12(11)14-7-8-15-10(2)13(9)14/h3-6,10H,7-8H2,1-2H3.
What are the key properties of 1,10-dimethyl-3,4-dihydro-1H-[1,4]oxazino[4,3-a]indole?
1,10-dimethyl-3,4-dihydro-1H-[1,4]oxazino[4,3-a]indole has a molecular weight of 201.27 g/mol, XLogP of 3.04, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,10-dimethyl-3,4-dihydro-1H-[1,4]oxazino[4,3-a]indole is sourced from PubChem (CID 86733524), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).