4-methyl-2-phenylbenzo[b][1,8]naphthyridin-5-amine

C19H15N3 — CID 151397277

IUPAC4-methyl-2-phenylbenzo[b][1,8]naphthyridin-5-amine
SMILESCc1cc(-c2ccccc2)nc2nc3ccccc3c(N)c12
InChIInChI=1S/C19H15N3/c1-12-11-16(13-7-3-2-4-8-13)22-19-17(12)18(20)14-9-5-6-10-15(14)21-19/h2-11H,1H3,(H2,20,21,22)
InChIKeyOVSQSVLCJUHPBO-UHFFFAOYSA-N
MW285.35 g/mol
LogP4.34
Rot. Bonds1

About 4-methyl-2-phenylbenzo[b][1,8]naphthyridin-5-amine

4-methyl-2-phenylbenzo[b][1,8]naphthyridin-5-amine (PubChem CID 151397277) has the molecular formula C19H15N3 and a molecular weight of 285.35 g/mol. Its IUPAC name is 4-methyl-2-phenylbenzo[b][1,8]naphthyridin-5-amine.

Molecular Properties

Compound Name4-methyl-2-phenylbenzo[b][1,8]naphthyridin-5-amine
PubChem CID151397277
Molecular FormulaC19H15N3
Molecular Weight285.35 g/mol
Exact Mass285.13
IUPAC Name4-methyl-2-phenylbenzo[b][1,8]naphthyridin-5-amine
SMILESCc1cc(-c2ccccc2)nc2nc3ccccc3c(N)c12
InChIInChI=1S/C19H15N3/c1-12-11-16(13-7-3-2-4-8-13)22-19-17(12)18(20)14-9-5-6-10-15(14)21-19/h2-11H,1H3,(H2,20,21,22)
InChIKeyOVSQSVLCJUHPBO-UHFFFAOYSA-N
XLogP4.34
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.35
LogP ≤ 54.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}

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Related Compounds

2-phenylquinolin-4-amine;hydrochloride
CID 134690731
2-phenylquinolin-4-amine;hydrate
CID 51057793
3,4-dimethyl-6-phenylpyrazolo[3,4-b]pyridin-2-amine
CID 70626416
2-(4-iodophenyl)-4-methylquinoline
CID 8966469
5-methyl-3-phenylisoquinolin-1-amine
CID 58517503
6,8-dimethyl-2-phenylquinolin-4-amine
CID 62201634
4-methyl-2-[4-(trifluoromethyl)phenyl]quinoline
CID 59274673
2-methylquinolin-4-amine
CID 162035180
acridin-9-amine;λ2-plumbane
CID 173496858
3-bromo-2-methylquinolin-4-amine;hydrochloride
CID 3022129
trimethyl-(2-phenylquinolin-4-yl)silane
CID 14530271
(2-phenylquinolin-4-yl)methanamine;hydrochloride
CID 82025622

Frequently Asked Questions

What is the IUPAC name of 4-methyl-2-phenylbenzo[b][1,8]naphthyridin-5-amine?
The IUPAC name of 4-methyl-2-phenylbenzo[b][1,8]naphthyridin-5-amine (CID 151397277) is 4-methyl-2-phenylbenzo[b][1,8]naphthyridin-5-amine.
What is the SMILES notation for 4-methyl-2-phenylbenzo[b][1,8]naphthyridin-5-amine?
The canonical SMILES for 4-methyl-2-phenylbenzo[b][1,8]naphthyridin-5-amine is Cc1cc(-c2ccccc2)nc2nc3ccccc3c(N)c12.
What is the InChIKey of 4-methyl-2-phenylbenzo[b][1,8]naphthyridin-5-amine?
The InChIKey is OVSQSVLCJUHPBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15N3/c1-12-11-16(13-7-3-2-4-8-13)22-19-17(12)18(20)14-9-5-6-10-15(14)21-19/h2-11H,1H3,(H2,20,21,22).
What are the key properties of 4-methyl-2-phenylbenzo[b][1,8]naphthyridin-5-amine?
4-methyl-2-phenylbenzo[b][1,8]naphthyridin-5-amine has a molecular weight of 285.35 g/mol, XLogP of 4.34, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-2-phenylbenzo[b][1,8]naphthyridin-5-amine is sourced from PubChem (CID 151397277), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).