7-methoxy-N-[(4-methoxyphenyl)methyl]quinolin-4-amine

C18H18N2O2 — CID 44533388

IUPAC7-methoxy-N-[(4-methoxyphenyl)methyl]quinolin-4-amine
SMILESCOc1ccc(CNc2ccnc3cc(OC)ccc23)cc1
InChIInChI=1S/C18H18N2O2/c1-21-14-5-3-13(4-6-14)12-20-17-9-10-19-18-11-15(22-2)7-8-16(17)18/h3-11H,12H2,1-2H3,(H,19,20)
InChIKeyQIZOMDGHZMEOLO-UHFFFAOYSA-N
MW294.35 g/mol
LogP3.86
Rot. Bonds5

About 7-methoxy-N-[(4-methoxyphenyl)methyl]quinolin-4-amine

7-methoxy-N-[(4-methoxyphenyl)methyl]quinolin-4-amine (PubChem CID 44533388) has the molecular formula C18H18N2O2 and a molecular weight of 294.35 g/mol. Its IUPAC name is 7-methoxy-N-[(4-methoxyphenyl)methyl]quinolin-4-amine.

Molecular Properties

Compound Name7-methoxy-N-[(4-methoxyphenyl)methyl]quinolin-4-amine
PubChem CID44533388
Molecular FormulaC18H18N2O2
Molecular Weight294.35 g/mol
Exact Mass294.14
IUPAC Name7-methoxy-N-[(4-methoxyphenyl)methyl]quinolin-4-amine
SMILESCOc1ccc(CNc2ccnc3cc(OC)ccc23)cc1
InChIInChI=1S/C18H18N2O2/c1-21-14-5-3-13(4-6-14)12-20-17-9-10-19-18-11-15(22-2)7-8-16(17)18/h3-11H,12H2,1-2H3,(H,19,20)
InChIKeyQIZOMDGHZMEOLO-UHFFFAOYSA-N
XLogP3.86
TPSA43.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.35
LogP ≤ 53.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 7-methoxy-N-[(4-methoxyphenyl)methyl]quinolin-4-amine?
The IUPAC name of 7-methoxy-N-[(4-methoxyphenyl)methyl]quinolin-4-amine (CID 44533388) is 7-methoxy-N-[(4-methoxyphenyl)methyl]quinolin-4-amine.
What is the SMILES notation for 7-methoxy-N-[(4-methoxyphenyl)methyl]quinolin-4-amine?
The canonical SMILES for 7-methoxy-N-[(4-methoxyphenyl)methyl]quinolin-4-amine is COc1ccc(CNc2ccnc3cc(OC)ccc23)cc1.
What is the InChIKey of 7-methoxy-N-[(4-methoxyphenyl)methyl]quinolin-4-amine?
The InChIKey is QIZOMDGHZMEOLO-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N2O2/c1-21-14-5-3-13(4-6-14)12-20-17-9-10-19-18-11-15(22-2)7-8-16(17)18/h3-11H,12H2,1-2H3,(H,19,20).
What are the key properties of 7-methoxy-N-[(4-methoxyphenyl)methyl]quinolin-4-amine?
7-methoxy-N-[(4-methoxyphenyl)methyl]quinolin-4-amine has a molecular weight of 294.35 g/mol, XLogP of 3.86, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methoxy-N-[(4-methoxyphenyl)methyl]quinolin-4-amine is sourced from PubChem (CID 44533388), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).