N-[(4-methoxyphenyl)methyl]-6-methylquinolin-4-amine

C18H18N2O — CID 133466915

IUPACN-[(4-methoxyphenyl)methyl]-6-methylquinolin-4-amine
SMILESCOc1ccc(CNc2ccnc3ccc(C)cc23)cc1
InChIInChI=1S/C18H18N2O/c1-13-3-8-17-16(11-13)18(9-10-19-17)20-12-14-4-6-15(21-2)7-5-14/h3-11H,12H2,1-2H3,(H,19,20)
InChIKeyNVSJOPUAEYOTBC-UHFFFAOYSA-N
MW278.36 g/mol
LogP4.16
Rot. Bonds4

About N-[(4-methoxyphenyl)methyl]-6-methylquinolin-4-amine

N-[(4-methoxyphenyl)methyl]-6-methylquinolin-4-amine (PubChem CID 133466915) has the molecular formula C18H18N2O and a molecular weight of 278.36 g/mol. Its IUPAC name is N-[(4-methoxyphenyl)methyl]-6-methylquinolin-4-amine.

Molecular Properties

Compound NameN-[(4-methoxyphenyl)methyl]-6-methylquinolin-4-amine
PubChem CID133466915
Molecular FormulaC18H18N2O
Molecular Weight278.36 g/mol
Exact Mass278.14
IUPAC NameN-[(4-methoxyphenyl)methyl]-6-methylquinolin-4-amine
SMILESCOc1ccc(CNc2ccnc3ccc(C)cc23)cc1
InChIInChI=1S/C18H18N2O/c1-13-3-8-17-16(11-13)18(9-10-19-17)20-12-14-4-6-15(21-2)7-5-14/h3-11H,12H2,1-2H3,(H,19,20)
InChIKeyNVSJOPUAEYOTBC-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

N-[(4-fluorophenyl)methyl]-6-methoxyquinolin-4-amine
CID 166633819
N,N'-bis(6-methylquinolin-4-yl)heptane-1,7-diamine
CID 118717458
2-fluoro-N-[(4-methoxyphenyl)methyl]-5-methylaniline
CID 28968417
N-[2-(4-chlorophenyl)ethyl]-6-methoxyquinolin-4-amine
CID 70112929
6-methyl-N-[[6-(4-methylpiperazin-1-yl)-3-pyridinyl]methyl]quinolin-4-amine
CID 133468020
1-N-[(4-methoxyphenyl)methyl]-4-methylbenzene-1,2-diamine;hydrochloride
CID 91826509
4-[[(7-methoxyquinolin-4-yl)amino]methyl]-N-methylbenzenesulfinamide
CID 166845406
2-N-[(4-methoxyphenyl)methyl]-4-N-[(4-methylphenyl)methyl]pyrimidine-2,4-diamine
CID 112890248
N-[(4-methoxyphenyl)methyl]-3-methyl-2H-pyrazolo[4,3-b]pyridin-7-amine
CID 138692712
2-N-(2,4-dimethylphenyl)-4-N-[(4-methoxyphenyl)methyl]pyrimidine-2,4-diamine
CID 112892431
2-[(4-methoxyphenyl)methylamino]-5-methylbenzonitrile
CID 107926880
8-methoxy-N-[(4-methylphenyl)methyl]quinolin-4-amine
CID 178086355

Frequently Asked Questions

What is the IUPAC name of N-[(4-methoxyphenyl)methyl]-6-methylquinolin-4-amine?
The IUPAC name of N-[(4-methoxyphenyl)methyl]-6-methylquinolin-4-amine (CID 133466915) is N-[(4-methoxyphenyl)methyl]-6-methylquinolin-4-amine.
What is the SMILES notation for N-[(4-methoxyphenyl)methyl]-6-methylquinolin-4-amine?
The canonical SMILES for N-[(4-methoxyphenyl)methyl]-6-methylquinolin-4-amine is COc1ccc(CNc2ccnc3ccc(C)cc23)cc1.
What is the InChIKey of N-[(4-methoxyphenyl)methyl]-6-methylquinolin-4-amine?
The InChIKey is NVSJOPUAEYOTBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N2O/c1-13-3-8-17-16(11-13)18(9-10-19-17)20-12-14-4-6-15(21-2)7-5-14/h3-11H,12H2,1-2H3,(H,19,20).
What are the key properties of N-[(4-methoxyphenyl)methyl]-6-methylquinolin-4-amine?
N-[(4-methoxyphenyl)methyl]-6-methylquinolin-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 N-[(4-methoxyphenyl)methyl]-6-methylquinolin-4-amine is sourced from PubChem (CID 133466915), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).