8-methoxy-N-[(4-methylphenyl)methyl]quinolin-4-amine

C18H18N2O — CID 178086355

IUPAC8-methoxy-N-[(4-methylphenyl)methyl]quinolin-4-amine
SMILESCOc1cccc2c(NCc3ccc(C)cc3)ccnc12
InChIInChI=1S/C18H18N2O/c1-13-6-8-14(9-7-13)12-20-16-10-11-19-18-15(16)4-3-5-17(18)21-2/h3-11H,12H2,1-2H3,(H,19,20)
InChIKeyBMMRQHPCYQCFJE-UHFFFAOYSA-N
MW278.36 g/mol
LogP4.16
Rot. Bonds4

About 8-methoxy-N-[(4-methylphenyl)methyl]quinolin-4-amine

8-methoxy-N-[(4-methylphenyl)methyl]quinolin-4-amine (PubChem CID 178086355) has the molecular formula C18H18N2O and a molecular weight of 278.36 g/mol. Its IUPAC name is 8-methoxy-N-[(4-methylphenyl)methyl]quinolin-4-amine.

Molecular Properties

Compound Name8-methoxy-N-[(4-methylphenyl)methyl]quinolin-4-amine
PubChem CID178086355
Molecular FormulaC18H18N2O
Molecular Weight278.36 g/mol
Exact Mass278.14
IUPAC Name8-methoxy-N-[(4-methylphenyl)methyl]quinolin-4-amine
SMILESCOc1cccc2c(NCc3ccc(C)cc3)ccnc12
InChIInChI=1S/C18H18N2O/c1-13-6-8-14(9-7-13)12-20-16-10-11-19-18-15(16)4-3-5-17(18)21-2/h3-11H,12H2,1-2H3,(H,19,20)
InChIKeyBMMRQHPCYQCFJE-UHFFFAOYSA-N
XLogP4.16
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.36
LogP ≤ 54.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

8-methoxy-N-[[5-[(2-methylpropan-2-yl)oxymethyl]-1,2-oxazol-3-yl]methyl]quinolin-4-amine
CID 133498541
N-[(4-methoxyphenyl)methyl]-6-methylquinolin-4-amine
CID 133466915
2-[2-methoxy-5-[[(8-methylquinolin-4-yl)amino]methyl]phenoxy]butanenitrile
CID 133388932
2,2-difluoro-N-[5-[(8-methoxyquinolin-4-yl)amino]pentyl]acetamide
CID 138585653
2-methoxy-4-methyl-N-[(4-methylphenyl)methyl]aniline
CID 54865900
N-[(1-tert-butyltriazol-4-yl)methyl]-8-methoxyquinolin-4-amine;2,2,2-trifluoroacetic acid
CID 166319090
8-methoxy-N-(1-phenylethyl)quinolin-4-amine
CID 142630068
2-(2,3-dimethoxyphenoxy)-N-[(4-methylphenyl)methyl]acetamide
CID 112978354
(8-methoxyquinolin-4-yl)methanol
CID 86714571
N-methyl-N-[4-[[(8-methylquinolin-4-yl)amino]methyl]phenyl]methanesulfonamide
CID 133388801
4-[[(8-methylquinolin-5-yl)amino]methyl]phenol
CID 43731510
N-[(4-bromophenyl)methyl]-5-methoxyisoquinolin-1-amine
CID 106537400

Frequently Asked Questions

What is the IUPAC name of 8-methoxy-N-[(4-methylphenyl)methyl]quinolin-4-amine?
The IUPAC name of 8-methoxy-N-[(4-methylphenyl)methyl]quinolin-4-amine (CID 178086355) is 8-methoxy-N-[(4-methylphenyl)methyl]quinolin-4-amine.
What is the SMILES notation for 8-methoxy-N-[(4-methylphenyl)methyl]quinolin-4-amine?
The canonical SMILES for 8-methoxy-N-[(4-methylphenyl)methyl]quinolin-4-amine is COc1cccc2c(NCc3ccc(C)cc3)ccnc12.
What is the InChIKey of 8-methoxy-N-[(4-methylphenyl)methyl]quinolin-4-amine?
The InChIKey is BMMRQHPCYQCFJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N2O/c1-13-6-8-14(9-7-13)12-20-16-10-11-19-18-15(16)4-3-5-17(18)21-2/h3-11H,12H2,1-2H3,(H,19,20).
What are the key properties of 8-methoxy-N-[(4-methylphenyl)methyl]quinolin-4-amine?
8-methoxy-N-[(4-methylphenyl)methyl]quinolin-4-amine has a molecular weight of 278.36 g/mol, XLogP of 4.16, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 8-methoxy-N-[(4-methylphenyl)methyl]quinolin-4-amine is sourced from PubChem (CID 178086355), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).