2-methylphenanthridine

C14H11N — CID 14384826

IUPAC2-methylphenanthridine
SMILESCc1ccc2ncc3ccccc3c2c1
InChIInChI=1S/C14H11N/c1-10-6-7-14-13(8-10)12-5-3-2-4-11(12)9-15-14/h2-9H,1H3
InChIKeyXJEDMWZLWOWOSZ-UHFFFAOYSA-N
MW193.25 g/mol
LogP3.70
Rot. Bonds

About 2-methylphenanthridine

2-methylphenanthridine (PubChem CID 14384826) has the molecular formula C14H11N and a molecular weight of 193.25 g/mol. Its IUPAC name is 2-methylphenanthridine.

Molecular Properties

Compound Name2-methylphenanthridine
PubChem CID14384826
Molecular FormulaC14H11N
Molecular Weight193.25 g/mol
Exact Mass193.09
IUPAC Name2-methylphenanthridine
SMILESCc1ccc2ncc3ccccc3c2c1
InChIInChI=1S/C14H11N/c1-10-6-7-14-13(8-10)12-5-3-2-4-11(12)9-15-14/h2-9H,1H3
InChIKeyXJEDMWZLWOWOSZ-UHFFFAOYSA-N
XLogP3.70
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.25
LogP ≤ 53.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze 2-methylphenanthridine 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

9-methylphenanthridine
CID 10987123
phenanthridine
CID 9189
2-methyl-9-[2-(6-methylphenanthren-3-yl)ethyl]phenanthridine
CID 134512257
phenanthridine;platinum(2+)
CID 23616726
phenanthridin-2-yl methanesulfonate
CID 154457207
2-nitrophenanthridine
CID 15065495
2,9-dimethylbenzo[c]cinnoline
CID 14472808
2-methylbenzo[j]phenanthridine-7,12-dione
CID 57328334
10-methylphenanthridine
CID 101052009
10-azapentacyclo[12.8.0.03,12.04,9.017,22]docosa-1,3(12),4,6,8,10,13,15,17,19,21-undecaene
CID 15831757
2-methylchromeno[3,2-c]quinolin-7-one
CID 139223040
6-methyl-4-phenylquinoline-3-carbonitrile
CID 141436065

Frequently Asked Questions

What is the IUPAC name of 2-methylphenanthridine?
The IUPAC name of 2-methylphenanthridine (CID 14384826) is 2-methylphenanthridine.
What is the SMILES notation for 2-methylphenanthridine?
The canonical SMILES for 2-methylphenanthridine is Cc1ccc2ncc3ccccc3c2c1.
What is the InChIKey of 2-methylphenanthridine?
The InChIKey is XJEDMWZLWOWOSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11N/c1-10-6-7-14-13(8-10)12-5-3-2-4-11(12)9-15-14/h2-9H,1H3.
What are the key properties of 2-methylphenanthridine?
2-methylphenanthridine has a molecular weight of 193.25 g/mol, XLogP of 3.70, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methylphenanthridine is sourced from PubChem (CID 14384826), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).