2-methyl-N-[1-(4-methylphenyl)ethyl]quinolin-4-amine

C19H20N2 — CID 63541977

IUPAC2-methyl-N-[1-(4-methylphenyl)ethyl]quinolin-4-amine
SMILESCc1ccc(C(C)Nc2cc(C)nc3ccccc23)cc1
InChIInChI=1S/C19H20N2/c1-13-8-10-16(11-9-13)15(3)21-19-12-14(2)20-18-7-5-4-6-17(18)19/h4-12,15H,1-3H3,(H,20,21)
InChIKeyAAARCTDWWXCOPZ-UHFFFAOYSA-N
MW276.38 g/mol
LogP5.02
Rot. Bonds3

About 2-methyl-N-[1-(4-methylphenyl)ethyl]quinolin-4-amine

2-methyl-N-[1-(4-methylphenyl)ethyl]quinolin-4-amine (PubChem CID 63541977) has the molecular formula C19H20N2 and a molecular weight of 276.38 g/mol. Its IUPAC name is 2-methyl-N-[1-(4-methylphenyl)ethyl]quinolin-4-amine.

Molecular Properties

Compound Name2-methyl-N-[1-(4-methylphenyl)ethyl]quinolin-4-amine
PubChem CID63541977
Molecular FormulaC19H20N2
Molecular Weight276.38 g/mol
Exact Mass276.16
IUPAC Name2-methyl-N-[1-(4-methylphenyl)ethyl]quinolin-4-amine
SMILESCc1ccc(C(C)Nc2cc(C)nc3ccccc23)cc1
InChIInChI=1S/C19H20N2/c1-13-8-10-16(11-9-13)15(3)21-19-12-14(2)20-18-7-5-4-6-17(18)19/h4-12,15H,1-3H3,(H,20,21)
InChIKeyAAARCTDWWXCOPZ-UHFFFAOYSA-N
XLogP5.02
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500276.38
LogP ≤ 55.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[1-(4-aminophenyl)ethyl]-2-methylquinolin-4-amine
CID 60869079
N-[1-(4-chlorophenyl)ethyl]-2-methylquinolin-4-amine
CID 60716471
N-[1-(2,4-dimethyl-1,3-thiazol-5-yl)ethyl]-2-methylquinolin-4-amine
CID 61064036
2-[(2-methylquinolin-4-yl)amino]propanoic acid
CID 43525417
2-methyl-N-(5-methylhexan-2-yl)quinolin-4-amine
CID 63926717
N-(4-chloro-3-methylbutan-2-yl)-2-methylquinolin-4-amine
CID 113484976
4-N-[1-(4-methylphenyl)ethyl]quinazoline-2,4-diamine
CID 80783257
2-methyl-N-[1-(4-methylphenyl)ethyl]aniline
CID 43196651
methyl 2-[(2-methylquinolin-4-yl)amino]propanoate
CID 43525443
2-methyl-N-[1-[2-methyl-3-(trifluoromethyl)phenyl]ethyl]quinolin-4-amine
CID 175944503
4-[1-(4-cyanophenyl)ethylamino]quinoline-2-carbonitrile
CID 133310735
2-methyl-N-(2-phenylpropyl)quinolin-4-amine
CID 104591691

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[1-(4-methylphenyl)ethyl]quinolin-4-amine?
The IUPAC name of 2-methyl-N-[1-(4-methylphenyl)ethyl]quinolin-4-amine (CID 63541977) is 2-methyl-N-[1-(4-methylphenyl)ethyl]quinolin-4-amine.
What is the SMILES notation for 2-methyl-N-[1-(4-methylphenyl)ethyl]quinolin-4-amine?
The canonical SMILES for 2-methyl-N-[1-(4-methylphenyl)ethyl]quinolin-4-amine is Cc1ccc(C(C)Nc2cc(C)nc3ccccc23)cc1.
What is the InChIKey of 2-methyl-N-[1-(4-methylphenyl)ethyl]quinolin-4-amine?
The InChIKey is AAARCTDWWXCOPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N2/c1-13-8-10-16(11-9-13)15(3)21-19-12-14(2)20-18-7-5-4-6-17(18)19/h4-12,15H,1-3H3,(H,20,21).
What are the key properties of 2-methyl-N-[1-(4-methylphenyl)ethyl]quinolin-4-amine?
2-methyl-N-[1-(4-methylphenyl)ethyl]quinolin-4-amine has a molecular weight of 276.38 g/mol, XLogP of 5.02, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[1-(4-methylphenyl)ethyl]quinolin-4-amine is sourced from PubChem (CID 63541977), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).