5,8-dichloro-3,6-dimethyl-N-propylquinolin-2-amine

C14H16Cl2N2 — CID 104728365

IUPAC5,8-dichloro-3,6-dimethyl-N-propylquinolin-2-amine
SMILESCCCNc1nc2c(Cl)cc(C)c(Cl)c2cc1C
InChIInChI=1S/C14H16Cl2N2/c1-4-5-17-14-9(3)6-10-12(16)8(2)7-11(15)13(10)18-14/h6-7H,4-5H2,1-3H3,(H,17,18)
InChIKeyGBWIGIJGXZPMRV-UHFFFAOYSA-N
MW283.20 g/mol
LogP4.98
Rot. Bonds3

About 5,8-dichloro-3,6-dimethyl-N-propylquinolin-2-amine

5,8-dichloro-3,6-dimethyl-N-propylquinolin-2-amine (PubChem CID 104728365) has the molecular formula C14H16Cl2N2 and a molecular weight of 283.20 g/mol. Its IUPAC name is 5,8-dichloro-3,6-dimethyl-N-propylquinolin-2-amine.

Molecular Properties

Compound Name5,8-dichloro-3,6-dimethyl-N-propylquinolin-2-amine
PubChem CID104728365
Molecular FormulaC14H16Cl2N2
Molecular Weight283.20 g/mol
Exact Mass282.07
IUPAC Name5,8-dichloro-3,6-dimethyl-N-propylquinolin-2-amine
SMILESCCCNc1nc2c(Cl)cc(C)c(Cl)c2cc1C
InChIInChI=1S/C14H16Cl2N2/c1-4-5-17-14-9(3)6-10-12(16)8(2)7-11(15)13(10)18-14/h6-7H,4-5H2,1-3H3,(H,17,18)
InChIKeyGBWIGIJGXZPMRV-UHFFFAOYSA-N
XLogP4.98
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.20
LogP ≤ 54.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-bromo-8-chloro-3-methyl-N-propylquinolin-2-amine
CID 63524554
5,8-dichloro-N,3-diethyl-6-methylquinolin-2-amine
CID 104728368
8-chloro-3-methyl-6-nitro-N-propylquinolin-2-amine
CID 63232514
(3-tert-butyl-5,8-dichloro-6-methylquinolin-2-yl)hydrazine
CID 113445996
6-fluoro-3,8-dimethyl-N-propylquinolin-2-amine
CID 63232719
3,5,7-trimethyl-N-propylquinolin-2-amine
CID 55224112
5-chloro-8-methyl-N,3-dipropylquinolin-2-amine
CID 55223167
5,8-dichloro-6-methyl-N-propyl-2-(trifluoromethyl)quinolin-4-amine
CID 104728229
6,8-dichloro-2-ethyl-3-methyl-N-propylquinolin-4-amine
CID 63562406
5,6,7-trifluoro-3-methyl-N-propylquinolin-2-amine
CID 63232523
3-methyl-N-propyl-1,7-phenanthrolin-2-amine
CID 63231772
5,6,7-trimethoxy-3-methyl-N-propylquinolin-2-amine
CID 63231688

Frequently Asked Questions

What is the IUPAC name of 5,8-dichloro-3,6-dimethyl-N-propylquinolin-2-amine?
The IUPAC name of 5,8-dichloro-3,6-dimethyl-N-propylquinolin-2-amine (CID 104728365) is 5,8-dichloro-3,6-dimethyl-N-propylquinolin-2-amine.
What is the SMILES notation for 5,8-dichloro-3,6-dimethyl-N-propylquinolin-2-amine?
The canonical SMILES for 5,8-dichloro-3,6-dimethyl-N-propylquinolin-2-amine is CCCNc1nc2c(Cl)cc(C)c(Cl)c2cc1C.
What is the InChIKey of 5,8-dichloro-3,6-dimethyl-N-propylquinolin-2-amine?
The InChIKey is GBWIGIJGXZPMRV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16Cl2N2/c1-4-5-17-14-9(3)6-10-12(16)8(2)7-11(15)13(10)18-14/h6-7H,4-5H2,1-3H3,(H,17,18).
What are the key properties of 5,8-dichloro-3,6-dimethyl-N-propylquinolin-2-amine?
5,8-dichloro-3,6-dimethyl-N-propylquinolin-2-amine has a molecular weight of 283.20 g/mol, XLogP of 4.98, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5,8-dichloro-3,6-dimethyl-N-propylquinolin-2-amine is sourced from PubChem (CID 104728365), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).