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

C18H18N2 — CID 79755193

IUPACN-[2-(2-methylphenyl)ethyl]quinolin-4-amine
SMILESCc1ccccc1CCNc1ccnc2ccccc12
InChIInChI=1S/C18H18N2/c1-14-6-2-3-7-15(14)10-12-19-18-11-13-20-17-9-5-4-8-16(17)18/h2-9,11,13H,10,12H2,1H3,(H,19,20)
InChIKeyAEFPDGLTIVTDCK-UHFFFAOYSA-N
MW262.36 g/mol
LogP4.20
Rot. Bonds4

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

N-[2-(2-methylphenyl)ethyl]quinolin-4-amine (PubChem CID 79755193) has the molecular formula C18H18N2 and a molecular weight of 262.36 g/mol. Its IUPAC name is N-[2-(2-methylphenyl)ethyl]quinolin-4-amine.

Molecular Properties

Compound NameN-[2-(2-methylphenyl)ethyl]quinolin-4-amine
PubChem CID79755193
Molecular FormulaC18H18N2
Molecular Weight262.36 g/mol
Exact Mass262.15
IUPAC NameN-[2-(2-methylphenyl)ethyl]quinolin-4-amine
SMILESCc1ccccc1CCNc1ccnc2ccccc12
InChIInChI=1S/C18H18N2/c1-14-6-2-3-7-15(14)10-12-19-18-11-13-20-17-9-5-4-8-16(17)18/h2-9,11,13H,10,12H2,1H3,(H,19,20)
InChIKeyAEFPDGLTIVTDCK-UHFFFAOYSA-N
XLogP4.20
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.36
LogP ≤ 54.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-methyl-N'-quinolin-4-ylethane-1,2-diamine
CID 62658935
N-[[2-[(quinolin-4-ylamino)methyl]phenyl]methyl]quinolin-4-amine
CID 67723222
N-ethylquinolin-4-amine
CID 15306588
N-[2-(furan-2-yl)ethyl]quinolin-4-amine
CID 61341916
N-(2-pyridin-3-ylethyl)quinolin-4-amine
CID 61339909
N'-cyclopropyl-N'-methyl-N-quinolin-4-ylethane-1,2-diamine
CID 62979742
2-chloro-N-[2-(2-methylphenyl)ethyl]aniline
CID 54796032
N-(5-chloropentyl)quinolin-4-amine
CID 107320544
N'-quinolin-4-ylpentane-1,5-diamine
CID 107323516
4-[2-(quinolin-4-ylamino)ethyl]benzene-1,2-diol;hydrate
CID 70111216
N-[(2-methylpyrimidin-4-yl)methyl]quinolin-4-amine
CID 61341548
3-N,3-N-diethyl-1-N-quinolin-4-ylbutane-1,3-diamine
CID 140608178

Frequently Asked Questions

What is the IUPAC name of N-[2-(2-methylphenyl)ethyl]quinolin-4-amine?
The IUPAC name of N-[2-(2-methylphenyl)ethyl]quinolin-4-amine (CID 79755193) is N-[2-(2-methylphenyl)ethyl]quinolin-4-amine.
What is the SMILES notation for N-[2-(2-methylphenyl)ethyl]quinolin-4-amine?
The canonical SMILES for N-[2-(2-methylphenyl)ethyl]quinolin-4-amine is Cc1ccccc1CCNc1ccnc2ccccc12.
What is the InChIKey of N-[2-(2-methylphenyl)ethyl]quinolin-4-amine?
The InChIKey is AEFPDGLTIVTDCK-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N2/c1-14-6-2-3-7-15(14)10-12-19-18-11-13-20-17-9-5-4-8-16(17)18/h2-9,11,13H,10,12H2,1H3,(H,19,20).
What are the key properties of N-[2-(2-methylphenyl)ethyl]quinolin-4-amine?
N-[2-(2-methylphenyl)ethyl]quinolin-4-amine has a molecular weight of 262.36 g/mol, XLogP of 4.20, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-methylphenyl)ethyl]quinolin-4-amine is sourced from PubChem (CID 79755193), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).