1-(2-methylquinolin-4-yl)-2-phenylethanamine

C18H18N2 — CID 105084872

IUPAC1-(2-methylquinolin-4-yl)-2-phenylethanamine
SMILESCc1cc(C(N)Cc2ccccc2)c2ccccc2n1
InChIInChI=1S/C18H18N2/c1-13-11-16(15-9-5-6-10-18(15)20-13)17(19)12-14-7-3-2-4-8-14/h2-11,17H,12,19H2,1H3
InChIKeyFAQICKBXADTYRZ-UHFFFAOYSA-N
MW262.36 g/mol
LogP3.79
Rot. Bonds3

About 1-(2-methylquinolin-4-yl)-2-phenylethanamine

1-(2-methylquinolin-4-yl)-2-phenylethanamine (PubChem CID 105084872) has the molecular formula C18H18N2 and a molecular weight of 262.36 g/mol. Its IUPAC name is 1-(2-methylquinolin-4-yl)-2-phenylethanamine.

Molecular Properties

Compound Name1-(2-methylquinolin-4-yl)-2-phenylethanamine
PubChem CID105084872
Molecular FormulaC18H18N2
Molecular Weight262.36 g/mol
Exact Mass262.15
IUPAC Name1-(2-methylquinolin-4-yl)-2-phenylethanamine
SMILESCc1cc(C(N)Cc2ccccc2)c2ccccc2n1
InChIInChI=1S/C18H18N2/c1-13-11-16(15-9-5-6-10-18(15)20-13)17(19)12-14-7-3-2-4-8-14/h2-11,17H,12,19H2,1H3
InChIKeyFAQICKBXADTYRZ-UHFFFAOYSA-N
XLogP3.79
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.36
LogP ≤ 53.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(3-methylphenyl)-1-(2-methylquinolin-4-yl)ethanamine
CID 105091263
2-(4-fluorophenyl)-1-(2-methylquinolin-4-yl)ethanamine
CID 105087104
2-(2-bromophenyl)-1-(2-methylquinolin-4-yl)ethanamine
CID 105087602
(3S)-3-amino-3-(2-methylquinolin-4-yl)propanamide
CID 79237707
1-(2-methylquinolin-4-yl)octan-1-amine
CID 105124901
2-(5-bromothiophen-2-yl)-1-(2-methylquinolin-4-yl)ethanamine
CID 105134705
1-(2-methylquinolin-4-yl)-2-(1,3-thiazol-5-yl)ethanamine
CID 105178009
ethyl 3-amino-3-(2-methylquinolin-4-yl)propanoate
CID 79237557
(3-ethylphenyl)-(2-methylquinolin-4-yl)methanamine
CID 105171179
1-(2-methylquinolin-4-yl)pentan-1-ol
CID 79235698
[1-(2-methylquinolin-4-yl)-2-pyridin-3-ylethyl]hydrazine
CID 105333737
N-methyl-1-(2-methylquinolin-4-yl)butan-1-amine
CID 105080240

Frequently Asked Questions

What is the IUPAC name of 1-(2-methylquinolin-4-yl)-2-phenylethanamine?
The IUPAC name of 1-(2-methylquinolin-4-yl)-2-phenylethanamine (CID 105084872) is 1-(2-methylquinolin-4-yl)-2-phenylethanamine.
What is the SMILES notation for 1-(2-methylquinolin-4-yl)-2-phenylethanamine?
The canonical SMILES for 1-(2-methylquinolin-4-yl)-2-phenylethanamine is Cc1cc(C(N)Cc2ccccc2)c2ccccc2n1.
What is the InChIKey of 1-(2-methylquinolin-4-yl)-2-phenylethanamine?
The InChIKey is FAQICKBXADTYRZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N2/c1-13-11-16(15-9-5-6-10-18(15)20-13)17(19)12-14-7-3-2-4-8-14/h2-11,17H,12,19H2,1H3.
What are the key properties of 1-(2-methylquinolin-4-yl)-2-phenylethanamine?
1-(2-methylquinolin-4-yl)-2-phenylethanamine has a molecular weight of 262.36 g/mol, XLogP of 3.79, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methylquinolin-4-yl)-2-phenylethanamine is sourced from PubChem (CID 105084872), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).