2-(2,5-dichlorophenyl)-1-quinolin-8-ylethanamine

C17H14Cl2N2 — CID 105151425

IUPAC2-(2,5-dichlorophenyl)-1-quinolin-8-ylethanamine
SMILESNC(Cc1cc(Cl)ccc1Cl)c1cccc2cccnc12
InChIInChI=1S/C17H14Cl2N2/c18-13-6-7-15(19)12(9-13)10-16(20)14-5-1-3-11-4-2-8-21-17(11)14/h1-9,16H,10,20H2
InChIKeyZCGBGOSUYKROTM-UHFFFAOYSA-N
MW317.22 g/mol
LogP4.78
Rot. Bonds3

About 2-(2,5-dichlorophenyl)-1-quinolin-8-ylethanamine

2-(2,5-dichlorophenyl)-1-quinolin-8-ylethanamine (PubChem CID 105151425) has the molecular formula C17H14Cl2N2 and a molecular weight of 317.22 g/mol. Its IUPAC name is 2-(2,5-dichlorophenyl)-1-quinolin-8-ylethanamine.

Molecular Properties

Compound Name2-(2,5-dichlorophenyl)-1-quinolin-8-ylethanamine
PubChem CID105151425
Molecular FormulaC17H14Cl2N2
Molecular Weight317.22 g/mol
Exact Mass316.05
IUPAC Name2-(2,5-dichlorophenyl)-1-quinolin-8-ylethanamine
SMILESNC(Cc1cc(Cl)ccc1Cl)c1cccc2cccnc12
InChIInChI=1S/C17H14Cl2N2/c18-13-6-7-15(19)12(9-13)10-16(20)14-5-1-3-11-4-2-8-21-17(11)14/h1-9,16H,10,20H2
InChIKeyZCGBGOSUYKROTM-UHFFFAOYSA-N
XLogP4.78
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.22
LogP ≤ 54.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2-bromo-3-fluorophenyl)-1-quinolin-8-ylethanamine
CID 105172118
2-(4-chlorophenoxy)-1-quinolin-8-ylethanamine
CID 105172449
2-(3-chlorophenyl)sulfanyl-1-quinolin-8-ylethanamine
CID 81229147
1-quinolin-8-ylethane-1,2-diamine
CID 63968089
2-(3,5-difluorophenyl)-1-quinolin-8-ylethanamine
CID 81227602
1-(5-chloro-2-fluorophenyl)-2-(2,5-dichlorophenyl)ethanamine
CID 114885921
2-(3,4-dichlorophenyl)-1-quinolin-8-ylethanol
CID 65148875
2-(2,5-dichlorophenyl)-1-pyridin-3-ylethanamine
CID 65321274
2-(2,5-dichlorophenyl)-1-quinolin-8-ylethanone
CID 105102618
1-quinolin-8-yl-2-thiophen-2-ylethanamine
CID 81231172
1-quinolin-8-ylbutan-1-amine
CID 79016206
1-quinolin-8-ylhexan-1-amine
CID 105021327

Frequently Asked Questions

What is the IUPAC name of 2-(2,5-dichlorophenyl)-1-quinolin-8-ylethanamine?
The IUPAC name of 2-(2,5-dichlorophenyl)-1-quinolin-8-ylethanamine (CID 105151425) is 2-(2,5-dichlorophenyl)-1-quinolin-8-ylethanamine.
What is the SMILES notation for 2-(2,5-dichlorophenyl)-1-quinolin-8-ylethanamine?
The canonical SMILES for 2-(2,5-dichlorophenyl)-1-quinolin-8-ylethanamine is NC(Cc1cc(Cl)ccc1Cl)c1cccc2cccnc12.
What is the InChIKey of 2-(2,5-dichlorophenyl)-1-quinolin-8-ylethanamine?
The InChIKey is ZCGBGOSUYKROTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14Cl2N2/c18-13-6-7-15(19)12(9-13)10-16(20)14-5-1-3-11-4-2-8-21-17(11)14/h1-9,16H,10,20H2.
What are the key properties of 2-(2,5-dichlorophenyl)-1-quinolin-8-ylethanamine?
2-(2,5-dichlorophenyl)-1-quinolin-8-ylethanamine has a molecular weight of 317.22 g/mol, XLogP of 4.78, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,5-dichlorophenyl)-1-quinolin-8-ylethanamine is sourced from PubChem (CID 105151425), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).