3,5-dichloro-6-(3-chloro-4-fluorophenyl)-N-ethylpyridin-2-amine

C13H10Cl3FN2 — CID 102753798

IUPAC3,5-dichloro-6-(3-chloro-4-fluorophenyl)-N-ethylpyridin-2-amine
SMILESCCNc1nc(-c2ccc(F)c(Cl)c2)c(Cl)cc1Cl
InChIInChI=1S/C13H10Cl3FN2/c1-2-18-13-10(16)6-9(15)12(19-13)7-3-4-11(17)8(14)5-7/h3-6H,2H2,1H3,(H,18,19)
InChIKeyDKWTULYTPZJORO-UHFFFAOYSA-N
MW319.59 g/mol
LogP5.28
Rot. Bonds3

About 3,5-dichloro-6-(3-chloro-4-fluorophenyl)-N-ethylpyridin-2-amine

3,5-dichloro-6-(3-chloro-4-fluorophenyl)-N-ethylpyridin-2-amine (PubChem CID 102753798) has the molecular formula C13H10Cl3FN2 and a molecular weight of 319.59 g/mol. Its IUPAC name is 3,5-dichloro-6-(3-chloro-4-fluorophenyl)-N-ethylpyridin-2-amine.

Molecular Properties

Compound Name3,5-dichloro-6-(3-chloro-4-fluorophenyl)-N-ethylpyridin-2-amine
PubChem CID102753798
Molecular FormulaC13H10Cl3FN2
Molecular Weight319.59 g/mol
Exact Mass317.99
IUPAC Name3,5-dichloro-6-(3-chloro-4-fluorophenyl)-N-ethylpyridin-2-amine
SMILESCCNc1nc(-c2ccc(F)c(Cl)c2)c(Cl)cc1Cl
InChIInChI=1S/C13H10Cl3FN2/c1-2-18-13-10(16)6-9(15)12(19-13)7-3-4-11(17)8(14)5-7/h3-6H,2H2,1H3,(H,18,19)
InChIKeyDKWTULYTPZJORO-UHFFFAOYSA-N
XLogP5.28
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500319.59
LogP ≤ 55.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3,5-dichloro-6-(3,4-difluorophenyl)-N-propylpyridin-2-amine
CID 102753267
3,5-dichloro-N-ethyl-6-(3-fluoro-5-methylphenyl)pyridin-2-amine
CID 102753577
6-(3-bromophenyl)-3,5-dichloro-N-ethylpyridin-2-amine
CID 102753784
3,5-dichloro-6-(3-ethoxyphenyl)-N-ethylpyridin-2-amine
CID 102753675
3,5-dichloro-N-ethyl-6-(1-methylpyrazol-4-yl)pyridin-2-amine
CID 102753146
3,5-dichloro-6-(3-fluorophenyl)-N-propylpyridin-2-amine
CID 102753089
3,5,6-trichloro-N-ethylpyridin-2-amine
CID 102750177
2-(3-chloro-4-fluorophenyl)-N-ethyl-5,6,7,8-tetrahydroquinazolin-4-amine
CID 63485428
3,5-dichloro-6-(2,5-difluorophenyl)-N-propylpyridin-2-amine
CID 102753304
3,5-dichloro-6-(4-chloro-2-fluorophenyl)-N-propylpyridin-2-amine
CID 102753661
3,5-dichloro-6-(2,5-dimethylphenyl)-N-ethylpyridin-2-amine
CID 102753209
3,5-dichloro-6-(2,4-difluorophenyl)sulfanyl-N-ethylpyridin-2-amine
CID 102761292

Frequently Asked Questions

What is the IUPAC name of 3,5-dichloro-6-(3-chloro-4-fluorophenyl)-N-ethylpyridin-2-amine?
The IUPAC name of 3,5-dichloro-6-(3-chloro-4-fluorophenyl)-N-ethylpyridin-2-amine (CID 102753798) is 3,5-dichloro-6-(3-chloro-4-fluorophenyl)-N-ethylpyridin-2-amine.
What is the SMILES notation for 3,5-dichloro-6-(3-chloro-4-fluorophenyl)-N-ethylpyridin-2-amine?
The canonical SMILES for 3,5-dichloro-6-(3-chloro-4-fluorophenyl)-N-ethylpyridin-2-amine is CCNc1nc(-c2ccc(F)c(Cl)c2)c(Cl)cc1Cl.
What is the InChIKey of 3,5-dichloro-6-(3-chloro-4-fluorophenyl)-N-ethylpyridin-2-amine?
The InChIKey is DKWTULYTPZJORO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10Cl3FN2/c1-2-18-13-10(16)6-9(15)12(19-13)7-3-4-11(17)8(14)5-7/h3-6H,2H2,1H3,(H,18,19).
What are the key properties of 3,5-dichloro-6-(3-chloro-4-fluorophenyl)-N-ethylpyridin-2-amine?
3,5-dichloro-6-(3-chloro-4-fluorophenyl)-N-ethylpyridin-2-amine has a molecular weight of 319.59 g/mol, XLogP of 5.28, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dichloro-6-(3-chloro-4-fluorophenyl)-N-ethylpyridin-2-amine is sourced from PubChem (CID 102753798), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).