2-(4-quinolin-4-ylphenyl)ethanamine

C17H16N2 — CID 110282335

IUPAC2-(4-quinolin-4-ylphenyl)ethanamine
SMILESNCCc1ccc(-c2ccnc3ccccc23)cc1
InChIInChI=1S/C17H16N2/c18-11-9-13-5-7-14(8-6-13)15-10-12-19-17-4-2-1-3-16(15)17/h1-8,10,12H,9,11,18H2
InChIKeyXFFRLZXWQYDPPL-UHFFFAOYSA-N
MW248.33 g/mol
LogP3.40
Rot. Bonds3

About 2-(4-quinolin-4-ylphenyl)ethanamine

2-(4-quinolin-4-ylphenyl)ethanamine (PubChem CID 110282335) has the molecular formula C17H16N2 and a molecular weight of 248.33 g/mol. Its IUPAC name is 2-(4-quinolin-4-ylphenyl)ethanamine.

Molecular Properties

Compound Name2-(4-quinolin-4-ylphenyl)ethanamine
PubChem CID110282335
Molecular FormulaC17H16N2
Molecular Weight248.33 g/mol
Exact Mass248.13
IUPAC Name2-(4-quinolin-4-ylphenyl)ethanamine
SMILESNCCc1ccc(-c2ccnc3ccccc23)cc1
InChIInChI=1S/C17H16N2/c18-11-9-13-5-7-14(8-6-13)15-10-12-19-17-4-2-1-3-16(15)17/h1-8,10,12H,9,11,18H2
InChIKeyXFFRLZXWQYDPPL-UHFFFAOYSA-N
XLogP3.40
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.33
LogP ≤ 53.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

cyclopenta[d][1]benzazepine
CID 90914140
2-[4-(3-methoxy-2-methyl-4-pyridinyl)phenyl]ethanamine;dihydrochloride
CID 163340695
4-[3-(2-phenylethyl)-2H-indazol-5-yl]quinoline
CID 20580711
4-naphthalen-2-ylquinoline
CID 14173372
(2-quinolin-4-ylphenyl)methanamine
CID 150465725
[6-phenyl-2,3-di(quinolin-4-yl)phenyl]methanamine
CID 57121415
2-[4-[2-(2-aminoethyl)phenyl]phenyl]ethanamine
CID 122383957
4-quinolin-4-ylbutan-1-amine
CID 10559963
4-pyrimidin-2-ylquinoline
CID 123157198
4,4,4-trichloro-1-(4-quinolin-4-ylphenyl)butan-1-one
CID 175348866
4-(4-naphthalen-1-ylnaphthalen-1-yl)quinoline
CID 71174827
4-[4-[4-(3,5-dipyridin-4-ylphenyl)-6-(4-quinolin-4-ylphenyl)-2-pyridinyl]phenyl]quinoline
CID 118603197

Frequently Asked Questions

What is the IUPAC name of 2-(4-quinolin-4-ylphenyl)ethanamine?
The IUPAC name of 2-(4-quinolin-4-ylphenyl)ethanamine (CID 110282335) is 2-(4-quinolin-4-ylphenyl)ethanamine.
What is the SMILES notation for 2-(4-quinolin-4-ylphenyl)ethanamine?
The canonical SMILES for 2-(4-quinolin-4-ylphenyl)ethanamine is NCCc1ccc(-c2ccnc3ccccc23)cc1.
What is the InChIKey of 2-(4-quinolin-4-ylphenyl)ethanamine?
The InChIKey is XFFRLZXWQYDPPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16N2/c18-11-9-13-5-7-14(8-6-13)15-10-12-19-17-4-2-1-3-16(15)17/h1-8,10,12H,9,11,18H2.
What are the key properties of 2-(4-quinolin-4-ylphenyl)ethanamine?
2-(4-quinolin-4-ylphenyl)ethanamine has a molecular weight of 248.33 g/mol, XLogP of 3.40, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-quinolin-4-ylphenyl)ethanamine is sourced from PubChem (CID 110282335), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).