7-methoxy-N-(3-methylphenyl)quinolin-4-amine

C17H16N2O — CID 50877899

IUPAC7-methoxy-N-(3-methylphenyl)quinolin-4-amine
SMILESCOc1ccc2c(Nc3cccc(C)c3)ccnc2c1
InChIInChI=1S/C17H16N2O/c1-12-4-3-5-13(10-12)19-16-8-9-18-17-11-14(20-2)6-7-15(16)17/h3-11H,1-2H3,(H,18,19)
InChIKeyNIDSAXHMUPXQNM-UHFFFAOYSA-N
MW264.33 g/mol
LogP4.30
Rot. Bonds3

About 7-methoxy-N-(3-methylphenyl)quinolin-4-amine

7-methoxy-N-(3-methylphenyl)quinolin-4-amine (PubChem CID 50877899) has the molecular formula C17H16N2O and a molecular weight of 264.33 g/mol. Its IUPAC name is 7-methoxy-N-(3-methylphenyl)quinolin-4-amine.

Molecular Properties

Compound Name7-methoxy-N-(3-methylphenyl)quinolin-4-amine
PubChem CID50877899
Molecular FormulaC17H16N2O
Molecular Weight264.33 g/mol
Exact Mass264.13
IUPAC Name7-methoxy-N-(3-methylphenyl)quinolin-4-amine
SMILESCOc1ccc2c(Nc3cccc(C)c3)ccnc2c1
InChIInChI=1S/C17H16N2O/c1-12-4-3-5-13(10-12)19-16-8-9-18-17-11-14(20-2)6-7-15(16)17/h3-11H,1-2H3,(H,18,19)
InChIKeyNIDSAXHMUPXQNM-UHFFFAOYSA-N
XLogP4.30
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.33
LogP ≤ 54.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 7-methoxy-N-(3-methylphenyl)quinolin-4-amine?
The IUPAC name of 7-methoxy-N-(3-methylphenyl)quinolin-4-amine (CID 50877899) is 7-methoxy-N-(3-methylphenyl)quinolin-4-amine.
What is the SMILES notation for 7-methoxy-N-(3-methylphenyl)quinolin-4-amine?
The canonical SMILES for 7-methoxy-N-(3-methylphenyl)quinolin-4-amine is COc1ccc2c(Nc3cccc(C)c3)ccnc2c1.
What is the InChIKey of 7-methoxy-N-(3-methylphenyl)quinolin-4-amine?
The InChIKey is NIDSAXHMUPXQNM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16N2O/c1-12-4-3-5-13(10-12)19-16-8-9-18-17-11-14(20-2)6-7-15(16)17/h3-11H,1-2H3,(H,18,19).
What are the key properties of 7-methoxy-N-(3-methylphenyl)quinolin-4-amine?
7-methoxy-N-(3-methylphenyl)quinolin-4-amine has a molecular weight of 264.33 g/mol, XLogP of 4.30, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methoxy-N-(3-methylphenyl)quinolin-4-amine is sourced from PubChem (CID 50877899), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).