7-methyl-6-(4-methylphenyl)phenanthridine

C21H17N — CID 135007702

IUPAC7-methyl-6-(4-methylphenyl)phenanthridine
SMILESCc1ccc(-c2nc3ccccc3c3cccc(C)c23)cc1
InChIInChI=1S/C21H17N/c1-14-10-12-16(13-11-14)21-20-15(2)6-5-8-18(20)17-7-3-4-9-19(17)22-21/h3-13H,1-2H3
InChIKeyYWIUQKHUKUOZFN-UHFFFAOYSA-N
MW283.37 g/mol
LogP5.67
Rot. Bonds1

About 7-methyl-6-(4-methylphenyl)phenanthridine

7-methyl-6-(4-methylphenyl)phenanthridine (PubChem CID 135007702) has the molecular formula C21H17N and a molecular weight of 283.37 g/mol. Its IUPAC name is 7-methyl-6-(4-methylphenyl)phenanthridine.

Molecular Properties

Compound Name7-methyl-6-(4-methylphenyl)phenanthridine
PubChem CID135007702
Molecular FormulaC21H17N
Molecular Weight283.37 g/mol
Exact Mass283.14
IUPAC Name7-methyl-6-(4-methylphenyl)phenanthridine
SMILESCc1ccc(-c2nc3ccccc3c3cccc(C)c23)cc1
InChIInChI=1S/C21H17N/c1-14-10-12-16(13-11-14)21-20-15(2)6-5-8-18(20)17-7-3-4-9-19(17)22-21/h3-13H,1-2H3
InChIKeyYWIUQKHUKUOZFN-UHFFFAOYSA-N
XLogP5.67
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500283.37
LogP ≤ 55.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

6-(4-methylphenyl)phenanthridine
CID 10707098
5-methyl-2,4-diphenylquinazoline
CID 126746855
4-(4-methylphenyl)furo[2,3-c]quinoline
CID 166570103
3,5-dimethyl-2,4-diphenylquinoline
CID 86174433
(4-benzo[k]phenanthridin-6-ylphenyl)-bis(2,6-dimethylphenyl)borane
CID 164784193
2-chloro-4-(4-methylphenyl)quinazoline
CID 3122268
22-phenyl-21-azapentacyclo[12.8.0.02,11.03,8.015,20]docosa-1(14),2(11),3,5,7,9,12,15,17,19,21-undecaene
CID 102575724
7,14-dimethyl-6,13-bis(4-pyridin-4-ylphenyl)quinolino[4,3-j]phenanthridine
CID 134595926
12-(4-dibenzothiophen-4-ylphenyl)-[1]benzothiolo[2,3-i]phenanthridine
CID 129123000
6-(3,5-dimethylphenyl)phenanthridine
CID 122398560
5-[4-[4-[4-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]phenyl]benzo[i]phenanthridine
CID 147439693
5-[4-[4-[4-[4,6-bis(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]phenyl]benzo[i]phenanthridine
CID 147611167

Frequently Asked Questions

What is the IUPAC name of 7-methyl-6-(4-methylphenyl)phenanthridine?
The IUPAC name of 7-methyl-6-(4-methylphenyl)phenanthridine (CID 135007702) is 7-methyl-6-(4-methylphenyl)phenanthridine.
What is the SMILES notation for 7-methyl-6-(4-methylphenyl)phenanthridine?
The canonical SMILES for 7-methyl-6-(4-methylphenyl)phenanthridine is Cc1ccc(-c2nc3ccccc3c3cccc(C)c23)cc1.
What is the InChIKey of 7-methyl-6-(4-methylphenyl)phenanthridine?
The InChIKey is YWIUQKHUKUOZFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H17N/c1-14-10-12-16(13-11-14)21-20-15(2)6-5-8-18(20)17-7-3-4-9-19(17)22-21/h3-13H,1-2H3.
What are the key properties of 7-methyl-6-(4-methylphenyl)phenanthridine?
7-methyl-6-(4-methylphenyl)phenanthridine has a molecular weight of 283.37 g/mol, XLogP of 5.67, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methyl-6-(4-methylphenyl)phenanthridine is sourced from PubChem (CID 135007702), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).