(4-phenanthridin-6-ylphenyl)methanamine

C20H16N2 — CID 174909278

IUPAC(4-phenanthridin-6-ylphenyl)methanamine
SMILESNCc1ccc(-c2nc3ccccc3c3ccccc23)cc1
InChIInChI=1S/C20H16N2/c21-13-14-9-11-15(12-10-14)20-18-7-2-1-5-16(18)17-6-3-4-8-19(17)22-20/h1-12H,13,21H2
InChIKeyLJQFZMQTSQMBBC-UHFFFAOYSA-N
MW284.36 g/mol
LogP4.51
Rot. Bonds2

About (4-phenanthridin-6-ylphenyl)methanamine

(4-phenanthridin-6-ylphenyl)methanamine (PubChem CID 174909278) has the molecular formula C20H16N2 and a molecular weight of 284.36 g/mol. Its IUPAC name is (4-phenanthridin-6-ylphenyl)methanamine.

Molecular Properties

Compound Name(4-phenanthridin-6-ylphenyl)methanamine
PubChem CID174909278
Molecular FormulaC20H16N2
Molecular Weight284.36 g/mol
Exact Mass284.13
IUPAC Name(4-phenanthridin-6-ylphenyl)methanamine
SMILESNCc1ccc(-c2nc3ccccc3c3ccccc23)cc1
InChIInChI=1S/C20H16N2/c21-13-14-9-11-15(12-10-14)20-18-7-2-1-5-16(18)17-6-3-4-8-19(17)22-20/h1-12H,13,21H2
InChIKeyLJQFZMQTSQMBBC-UHFFFAOYSA-N
XLogP4.51
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.36
LogP ≤ 54.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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
[4-(6,7-dichloro-3-phenylquinoxalin-2-yl)phenyl]methanamine
CID 58524219
[4-(5-phenyl-2H-triazol-4-yl)phenyl]methanamine
CID 174848978
6-[3-[4-(3-phenanthridin-6-ylphenyl)-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]phenanthridine
CID 129265621
[4-(3,5-diphenyl-1,6-naphthyridin-2-yl)phenyl]methanamine;dihydrochloride
CID 173038029
[4-[8-(sulfonatomethyl)phenanthridin-6-yl]phenyl]methanesulfonate
CID 140622631
6-[4-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)-5-naphthalen-1-ylphenyl]phenyl]phenanthridine
CID 129201356
6-(3,5-dimethylphenyl)phenanthridine
CID 122398560
3-(4-phenanthridin-6-ylphenoxy)propane-1-sulfinate
CID 126516361
phenylmethanamine;titanium(2+)
CID 21287655
2,6-dinaphthalen-1-yl-4-(4-phenanthridin-6-ylphenyl)benzo[h]quinoline
CID 70958772
3-[4-(aminomethyl)phenyl]-6-bromo-2-phenylquinoxalin-5-ol
CID 136649032

Frequently Asked Questions

What is the IUPAC name of (4-phenanthridin-6-ylphenyl)methanamine?
The IUPAC name of (4-phenanthridin-6-ylphenyl)methanamine (CID 174909278) is (4-phenanthridin-6-ylphenyl)methanamine.
What is the SMILES notation for (4-phenanthridin-6-ylphenyl)methanamine?
The canonical SMILES for (4-phenanthridin-6-ylphenyl)methanamine is NCc1ccc(-c2nc3ccccc3c3ccccc23)cc1.
What is the InChIKey of (4-phenanthridin-6-ylphenyl)methanamine?
The InChIKey is LJQFZMQTSQMBBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H16N2/c21-13-14-9-11-15(12-10-14)20-18-7-2-1-5-16(18)17-6-3-4-8-19(17)22-20/h1-12H,13,21H2.
What are the key properties of (4-phenanthridin-6-ylphenyl)methanamine?
(4-phenanthridin-6-ylphenyl)methanamine has a molecular weight of 284.36 g/mol, XLogP of 4.51, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4-phenanthridin-6-ylphenyl)methanamine is sourced from PubChem (CID 174909278), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).