N-[2-(2,5-dichlorophenyl)quinolin-4-yl]-N',N'-dimethylethane-1,2-diamine

C19H19Cl2N3 — CID 3420186

IUPACN-[2-(2,5-dichlorophenyl)quinolin-4-yl]-N',N'-dimethylethane-1,2-diamine
SMILESCN(C)CCNc1cc(-c2cc(Cl)ccc2Cl)nc2ccccc12
InChIInChI=1S/C19H19Cl2N3/c1-24(2)10-9-22-18-12-19(15-11-13(20)7-8-16(15)21)23-17-6-4-3-5-14(17)18/h3-8,11-12H,9-10H2,1-2H3,(H,22,23)
InChIKeyLVIDLUGZHKSPFV-UHFFFAOYSA-N
MW360.29 g/mol
LogP5.18
Rot. Bonds5

About N-[2-(2,5-dichlorophenyl)quinolin-4-yl]-N',N'-dimethylethane-1,2-diamine

N-[2-(2,5-dichlorophenyl)quinolin-4-yl]-N',N'-dimethylethane-1,2-diamine (PubChem CID 3420186) has the molecular formula C19H19Cl2N3 and a molecular weight of 360.29 g/mol. Its IUPAC name is N-[2-(2,5-dichlorophenyl)quinolin-4-yl]-N',N'-dimethylethane-1,2-diamine.

Molecular Properties

Compound NameN-[2-(2,5-dichlorophenyl)quinolin-4-yl]-N',N'-dimethylethane-1,2-diamine
PubChem CID3420186
Molecular FormulaC19H19Cl2N3
Molecular Weight360.29 g/mol
Exact Mass359.10
IUPAC NameN-[2-(2,5-dichlorophenyl)quinolin-4-yl]-N',N'-dimethylethane-1,2-diamine
SMILESCN(C)CCNc1cc(-c2cc(Cl)ccc2Cl)nc2ccccc12
InChIInChI=1S/C19H19Cl2N3/c1-24(2)10-9-22-18-12-19(15-11-13(20)7-8-16(15)21)23-17-6-4-3-5-14(17)18/h3-8,11-12H,9-10H2,1-2H3,(H,22,23)
InChIKeyLVIDLUGZHKSPFV-UHFFFAOYSA-N
XLogP5.18
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500360.29
LogP ≤ 55.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(2,5-dichlorophenyl)quinolin-4-yl]-N',N'-dimethylethane-1,2-diamine;dihydrobromide
CID 45046156
N',N'-dimethyl-N-(2-naphthalen-2-ylquinolin-4-yl)ethane-1,2-diamine;hydrate
CID 51058348
N-[2-(1-benzofuran-2-yl)quinolin-4-yl]-N',N'-dimethylethane-1,2-diamine
CID 91938175
N-[2-(2,4-dichlorophenyl)quinazolin-4-yl]-N',N'-dimethylethane-1,2-diamine;hydrochloride
CID 18593626
1-[4-[bis(2-chloroethyl)amino]phenyl]-3-[[2-(2,5-dichlorophenyl)quinolin-4-yl]amino]urea
CID 69237454
bis(N',N'-dimethyl-N-(2-naphthalen-2-ylquinolin-4-yl)propane-1,3-diamine);dihydrochloride
CID 157354468
N',N'-dimethyl-N-(2-naphthalen-2-ylquinolin-4-yl)butane-1,4-diamine
CID 10451757
N-(4-chloroquinazolin-2-yl)-N',N'-dimethylethane-1,2-diamine
CID 121205342
2-(5-chloro-2-fluorophenyl)-N-(pyridin-3-ylmethyl)quinolin-4-amine
CID 70660144
N-(6-chloro-2-pyridin-2-ylquinolin-4-yl)-N',N'-diethylethane-1,2-diamine
CID 91938180
N-[4-[[2-(5-chloro-2-fluorophenyl)quinolin-4-yl]amino]-3-pyridinyl]-3-(dimethylamino)propanamide
CID 70660142
N-(5-chloro-2-methylphenyl)-N',N'-dimethylethane-1,2-diamine
CID 28562912

Frequently Asked Questions

What is the IUPAC name of N-[2-(2,5-dichlorophenyl)quinolin-4-yl]-N',N'-dimethylethane-1,2-diamine?
The IUPAC name of N-[2-(2,5-dichlorophenyl)quinolin-4-yl]-N',N'-dimethylethane-1,2-diamine (CID 3420186) is N-[2-(2,5-dichlorophenyl)quinolin-4-yl]-N',N'-dimethylethane-1,2-diamine.
What is the SMILES notation for N-[2-(2,5-dichlorophenyl)quinolin-4-yl]-N',N'-dimethylethane-1,2-diamine?
The canonical SMILES for N-[2-(2,5-dichlorophenyl)quinolin-4-yl]-N',N'-dimethylethane-1,2-diamine is CN(C)CCNc1cc(-c2cc(Cl)ccc2Cl)nc2ccccc12.
What is the InChIKey of N-[2-(2,5-dichlorophenyl)quinolin-4-yl]-N',N'-dimethylethane-1,2-diamine?
The InChIKey is LVIDLUGZHKSPFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19Cl2N3/c1-24(2)10-9-22-18-12-19(15-11-13(20)7-8-16(15)21)23-17-6-4-3-5-14(17)18/h3-8,11-12H,9-10H2,1-2H3,(H,22,23).
What are the key properties of N-[2-(2,5-dichlorophenyl)quinolin-4-yl]-N',N'-dimethylethane-1,2-diamine?
N-[2-(2,5-dichlorophenyl)quinolin-4-yl]-N',N'-dimethylethane-1,2-diamine has a molecular weight of 360.29 g/mol, XLogP of 5.18, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2,5-dichlorophenyl)quinolin-4-yl]-N',N'-dimethylethane-1,2-diamine is sourced from PubChem (CID 3420186), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).