3,8-dimethoxy-5-methylphenanthridin-6-one

C16H15NO3 — CID 164597930

IUPAC3,8-dimethoxy-5-methylphenanthridin-6-one
SMILESCOc1ccc2c(c1)c(=O)n(C)c1cc(OC)ccc21
InChIInChI=1S/C16H15NO3/c1-17-15-9-11(20-3)5-7-13(15)12-6-4-10(19-2)8-14(12)16(17)18/h4-9H,1-3H3
InChIKeyTZIGQIKCAPRQNI-UHFFFAOYSA-N
MW269.30 g/mol
LogP2.71
Rot. Bonds2

About 3,8-dimethoxy-5-methylphenanthridin-6-one

3,8-dimethoxy-5-methylphenanthridin-6-one (PubChem CID 164597930) has the molecular formula C16H15NO3 and a molecular weight of 269.30 g/mol. Its IUPAC name is 3,8-dimethoxy-5-methylphenanthridin-6-one.

Molecular Properties

Compound Name3,8-dimethoxy-5-methylphenanthridin-6-one
PubChem CID164597930
Molecular FormulaC16H15NO3
Molecular Weight269.30 g/mol
Exact Mass269.11
IUPAC Name3,8-dimethoxy-5-methylphenanthridin-6-one
SMILESCOc1ccc2c(c1)c(=O)n(C)c1cc(OC)ccc21
InChIInChI=1S/C16H15NO3/c1-17-15-9-11(20-3)5-7-13(15)12-6-4-10(19-2)8-14(12)16(17)18/h4-9H,1-3H3
InChIKeyTZIGQIKCAPRQNI-UHFFFAOYSA-N
XLogP2.71
TPSA40.46 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.30
LogP ≤ 52.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

Analyze 3,8-dimethoxy-5-methylphenanthridin-6-one with MolForge

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

Launch Full Analysis

Related Compounds

3,4,7-trimethoxy-1-methylquinolin-2-one
CID 20676861
4-hydroxy-3,7-dimethoxy-1-methylquinolin-2-one
CID 54737447
3-(aminomethyl)-7-methoxy-1,4-dimethylquinolin-2-one
CID 84626906
3,9-dimethoxy-5-methyl-[1]benzofuro[3,2-c]quinolin-6-one
CID 2794540
4-butoxy-3-hexoxy-7-methoxy-1-methylquinolin-2-one
CID 139717572
3-butoxy-4-hydroxy-7-methoxy-1-methylquinolin-2-one
CID 139717157
7-methoxy-2,4-dimethylisoquinolin-1-one
CID 115022865
7-methoxy-9-methylcarbazole-2-carbonitrile
CID 10847401
4-chloro-6-methoxy-1,3-dimethylquinolin-2-one
CID 171338243
3,4-dimethoxy-1-methyl-7-propan-2-yloxyquinolin-2-one
CID 139717812
7-methoxy-1-methyl-4-oxoquinoline-2-carboxylic acid
CID 82243051
6-methoxy-4-methyl-1H-quinoxaline-2,3-dione
CID 13437023

Frequently Asked Questions

What is the IUPAC name of 3,8-dimethoxy-5-methylphenanthridin-6-one?
The IUPAC name of 3,8-dimethoxy-5-methylphenanthridin-6-one (CID 164597930) is 3,8-dimethoxy-5-methylphenanthridin-6-one.
What is the SMILES notation for 3,8-dimethoxy-5-methylphenanthridin-6-one?
The canonical SMILES for 3,8-dimethoxy-5-methylphenanthridin-6-one is COc1ccc2c(c1)c(=O)n(C)c1cc(OC)ccc21.
What is the InChIKey of 3,8-dimethoxy-5-methylphenanthridin-6-one?
The InChIKey is TZIGQIKCAPRQNI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15NO3/c1-17-15-9-11(20-3)5-7-13(15)12-6-4-10(19-2)8-14(12)16(17)18/h4-9H,1-3H3.
What are the key properties of 3,8-dimethoxy-5-methylphenanthridin-6-one?
3,8-dimethoxy-5-methylphenanthridin-6-one has a molecular weight of 269.30 g/mol, XLogP of 2.71, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3,8-dimethoxy-5-methylphenanthridin-6-one is sourced from PubChem (CID 164597930), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).