8-chloro-2-(difluoromethyl)-N-ethylquinolin-4-amine

C12H11ClF2N2 — CID 62890710

IUPAC8-chloro-2-(difluoromethyl)-N-ethylquinolin-4-amine
SMILESCCNc1cc(C(F)F)nc2c(Cl)cccc12
InChIInChI=1S/C12H11ClF2N2/c1-2-16-9-6-10(12(14)15)17-11-7(9)4-3-5-8(11)13/h3-6,12H,2H2,1H3,(H,16,17)
InChIKeyGFDSGSWRMPXYAW-UHFFFAOYSA-N
MW256.68 g/mol
LogP4.26
Rot. Bonds3

About 8-chloro-2-(difluoromethyl)-N-ethylquinolin-4-amine

8-chloro-2-(difluoromethyl)-N-ethylquinolin-4-amine (PubChem CID 62890710) has the molecular formula C12H11ClF2N2 and a molecular weight of 256.68 g/mol. Its IUPAC name is 8-chloro-2-(difluoromethyl)-N-ethylquinolin-4-amine.

Molecular Properties

Compound Name8-chloro-2-(difluoromethyl)-N-ethylquinolin-4-amine
PubChem CID62890710
Molecular FormulaC12H11ClF2N2
Molecular Weight256.68 g/mol
Exact Mass256.06
IUPAC Name8-chloro-2-(difluoromethyl)-N-ethylquinolin-4-amine
SMILESCCNc1cc(C(F)F)nc2c(Cl)cccc12
InChIInChI=1S/C12H11ClF2N2/c1-2-16-9-6-10(12(14)15)17-11-7(9)4-3-5-8(11)13/h3-6,12H,2H2,1H3,(H,16,17)
InChIKeyGFDSGSWRMPXYAW-UHFFFAOYSA-N
XLogP4.26
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.68
LogP ≤ 54.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

8-chloro-2-propan-2-yl-N-propylquinolin-4-amine
CID 63480780
2-(difluoromethyl)-N-ethyl-8-(2-methoxyethyl)quinolin-4-amine
CID 102908090
7-chloro-2-(difluoromethyl)-N-ethyl-6-methylquinolin-4-amine
CID 113445336
8-(difluoromethoxy)-2-(difluoromethyl)-N-propylquinolin-4-amine
CID 62892984
8-chloro-N-ethylquinolin-4-amine
CID 62190462
N-ethyl-2-propan-2-yl-8-propylquinolin-4-amine
CID 63484564
5-bromo-2-(difluoromethyl)-N-ethyl-8-methylquinolin-4-amine
CID 62891074
2-(difluoromethyl)-7,8-dimethyl-N-propylquinolin-4-amine
CID 55127386
2-(difluoromethyl)-N-ethyl-5,6,8-trifluoroquinolin-4-amine
CID 62893164
4-chloro-2-(difluoromethyl)benzo[h]quinoline
CID 62890724
5-bromo-2-(difluoromethyl)-N-ethyl-6,8-difluoroquinolin-4-amine
CID 102854981
8-chloro-2-methyl-3-propan-2-yl-N-propylquinolin-4-amine
CID 63480623

Frequently Asked Questions

What is the IUPAC name of 8-chloro-2-(difluoromethyl)-N-ethylquinolin-4-amine?
The IUPAC name of 8-chloro-2-(difluoromethyl)-N-ethylquinolin-4-amine (CID 62890710) is 8-chloro-2-(difluoromethyl)-N-ethylquinolin-4-amine.
What is the SMILES notation for 8-chloro-2-(difluoromethyl)-N-ethylquinolin-4-amine?
The canonical SMILES for 8-chloro-2-(difluoromethyl)-N-ethylquinolin-4-amine is CCNc1cc(C(F)F)nc2c(Cl)cccc12.
What is the InChIKey of 8-chloro-2-(difluoromethyl)-N-ethylquinolin-4-amine?
The InChIKey is GFDSGSWRMPXYAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11ClF2N2/c1-2-16-9-6-10(12(14)15)17-11-7(9)4-3-5-8(11)13/h3-6,12H,2H2,1H3,(H,16,17).
What are the key properties of 8-chloro-2-(difluoromethyl)-N-ethylquinolin-4-amine?
8-chloro-2-(difluoromethyl)-N-ethylquinolin-4-amine has a molecular weight of 256.68 g/mol, XLogP of 4.26, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 8-chloro-2-(difluoromethyl)-N-ethylquinolin-4-amine is sourced from PubChem (CID 62890710), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).