6,8-dichloro-2-ethyl-3-methyl-N-propylquinolin-4-amine

C15H18Cl2N2 — CID 63562406

IUPAC6,8-dichloro-2-ethyl-3-methyl-N-propylquinolin-4-amine
SMILESCCCNc1c(C)c(CC)nc2c(Cl)cc(Cl)cc12
InChIInChI=1S/C15H18Cl2N2/c1-4-6-18-14-9(3)13(5-2)19-15-11(14)7-10(16)8-12(15)17/h7-8H,4-6H2,1-3H3,(H,18,19)
InChIKeyKMETXNVDFALHEI-UHFFFAOYSA-N
MW297.23 g/mol
LogP5.23
Rot. Bonds4

About 6,8-dichloro-2-ethyl-3-methyl-N-propylquinolin-4-amine

6,8-dichloro-2-ethyl-3-methyl-N-propylquinolin-4-amine (PubChem CID 63562406) has the molecular formula C15H18Cl2N2 and a molecular weight of 297.23 g/mol. Its IUPAC name is 6,8-dichloro-2-ethyl-3-methyl-N-propylquinolin-4-amine.

Molecular Properties

Compound Name6,8-dichloro-2-ethyl-3-methyl-N-propylquinolin-4-amine
PubChem CID63562406
Molecular FormulaC15H18Cl2N2
Molecular Weight297.23 g/mol
Exact Mass296.08
IUPAC Name6,8-dichloro-2-ethyl-3-methyl-N-propylquinolin-4-amine
SMILESCCCNc1c(C)c(CC)nc2c(Cl)cc(Cl)cc12
InChIInChI=1S/C15H18Cl2N2/c1-4-6-18-14-9(3)13(5-2)19-15-11(14)7-10(16)8-12(15)17/h7-8H,4-6H2,1-3H3,(H,18,19)
InChIKeyKMETXNVDFALHEI-UHFFFAOYSA-N
XLogP5.23
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500297.23
LogP ≤ 55.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

6-chloro-2-ethyl-8-iodo-3-methyl-N-propylquinolin-4-amine
CID 107628851
8-chloro-2-ethyl-3-methyl-N-propylquinolin-4-amine
CID 63560531
6-chloro-2,3,8-trimethyl-N-propylquinolin-4-amine
CID 63481134
5,7-dichloro-N-propyl-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine
CID 63481227
6,8-dichloro-2-ethyl-3-methylquinoline-4-carboxylic acid
CID 60984819
2-ethyl-5-fluoro-3,8-dimethyl-N-propylquinolin-4-amine
CID 63562434
6-tert-butyl-2-ethyl-3-methyl-N-propylquinolin-4-amine
CID 63553537
N,2-diethyl-3,6,8-trimethylquinolin-4-amine
CID 55220908
(5,6,8-trichloro-2-ethyl-3-methylquinolin-4-yl)hydrazine
CID 63553722
6,8-dichloro-2-(methoxymethyl)-N-propylquinolin-4-amine
CID 55062733
5-bromo-2-ethyl-6-fluoro-3,8-dimethyl-N-propylquinolin-4-amine
CID 107594008
7-chloro-5-methyl-N-propyl-1,2,3,4-tetrahydroacridin-9-amine
CID 63480982

Frequently Asked Questions

What is the IUPAC name of 6,8-dichloro-2-ethyl-3-methyl-N-propylquinolin-4-amine?
The IUPAC name of 6,8-dichloro-2-ethyl-3-methyl-N-propylquinolin-4-amine (CID 63562406) is 6,8-dichloro-2-ethyl-3-methyl-N-propylquinolin-4-amine.
What is the SMILES notation for 6,8-dichloro-2-ethyl-3-methyl-N-propylquinolin-4-amine?
The canonical SMILES for 6,8-dichloro-2-ethyl-3-methyl-N-propylquinolin-4-amine is CCCNc1c(C)c(CC)nc2c(Cl)cc(Cl)cc12.
What is the InChIKey of 6,8-dichloro-2-ethyl-3-methyl-N-propylquinolin-4-amine?
The InChIKey is KMETXNVDFALHEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18Cl2N2/c1-4-6-18-14-9(3)13(5-2)19-15-11(14)7-10(16)8-12(15)17/h7-8H,4-6H2,1-3H3,(H,18,19).
What are the key properties of 6,8-dichloro-2-ethyl-3-methyl-N-propylquinolin-4-amine?
6,8-dichloro-2-ethyl-3-methyl-N-propylquinolin-4-amine has a molecular weight of 297.23 g/mol, XLogP of 5.23, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6,8-dichloro-2-ethyl-3-methyl-N-propylquinolin-4-amine is sourced from PubChem (CID 63562406), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).