3,5-dichloro-6-(3-fluorophenyl)-N-propylpyridin-2-amine

C14H13Cl2FN2 — CID 102753089

IUPAC3,5-dichloro-6-(3-fluorophenyl)-N-propylpyridin-2-amine
SMILESCCCNc1nc(-c2cccc(F)c2)c(Cl)cc1Cl
InChIInChI=1S/C14H13Cl2FN2/c1-2-6-18-14-12(16)8-11(15)13(19-14)9-4-3-5-10(17)7-9/h3-5,7-8H,2,6H2,1H3,(H,18,19)
InChIKeyCIEULLBPUABWFL-UHFFFAOYSA-N
MW299.18 g/mol
LogP5.02
Rot. Bonds4

About 3,5-dichloro-6-(3-fluorophenyl)-N-propylpyridin-2-amine

3,5-dichloro-6-(3-fluorophenyl)-N-propylpyridin-2-amine (PubChem CID 102753089) has the molecular formula C14H13Cl2FN2 and a molecular weight of 299.18 g/mol. Its IUPAC name is 3,5-dichloro-6-(3-fluorophenyl)-N-propylpyridin-2-amine.

Molecular Properties

Compound Name3,5-dichloro-6-(3-fluorophenyl)-N-propylpyridin-2-amine
PubChem CID102753089
Molecular FormulaC14H13Cl2FN2
Molecular Weight299.18 g/mol
Exact Mass298.04
IUPAC Name3,5-dichloro-6-(3-fluorophenyl)-N-propylpyridin-2-amine
SMILESCCCNc1nc(-c2cccc(F)c2)c(Cl)cc1Cl
InChIInChI=1S/C14H13Cl2FN2/c1-2-6-18-14-12(16)8-11(15)13(19-14)9-4-3-5-10(17)7-9/h3-5,7-8H,2,6H2,1H3,(H,18,19)
InChIKeyCIEULLBPUABWFL-UHFFFAOYSA-N
XLogP5.02
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500299.18
LogP ≤ 55.02
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-[3,5-dichloro-6-(propylamino)-2-pyridinyl]-5-fluorobenzonitrile
CID 102753566
3,5-dichloro-6-(2,5-difluorophenyl)-N-propylpyridin-2-amine
CID 102753304
3,5-dichloro-6-(4-chloro-3-methoxyphenyl)-N-propylpyridin-2-amine
CID 102753582
3,5-dichloro-6-(4-chloro-2-fluorophenyl)-N-propylpyridin-2-amine
CID 102753661
3,5-dichloro-N-propyl-6-(2,4,5-trifluorophenyl)pyridin-2-amine
CID 102753760
3,5-dichloro-N-propyl-6-(1H-pyrrol-2-yl)pyridin-2-amine
CID 103341839
3,5-dichloro-6-(3-fluoro-4-pyridinyl)-N-propylpyridin-2-amine
CID 102753928
6-(3-bromophenyl)-3,5-dichloro-N-ethylpyridin-2-amine
CID 102753784
3,5-dichloro-6-(3-chloro-4-fluorophenyl)-N-ethylpyridin-2-amine
CID 102753798
3,5-dichloro-N-ethyl-6-(3-fluoro-5-methylphenyl)pyridin-2-amine
CID 102753577
2-cyclopropyl-6-(3-fluorophenyl)-5-methyl-N-propylpyrimidin-4-amine
CID 80977815

Frequently Asked Questions

What is the IUPAC name of 3,5-dichloro-6-(3-fluorophenyl)-N-propylpyridin-2-amine?
The IUPAC name of 3,5-dichloro-6-(3-fluorophenyl)-N-propylpyridin-2-amine (CID 102753089) is 3,5-dichloro-6-(3-fluorophenyl)-N-propylpyridin-2-amine.
What is the SMILES notation for 3,5-dichloro-6-(3-fluorophenyl)-N-propylpyridin-2-amine?
The canonical SMILES for 3,5-dichloro-6-(3-fluorophenyl)-N-propylpyridin-2-amine is CCCNc1nc(-c2cccc(F)c2)c(Cl)cc1Cl.
What is the InChIKey of 3,5-dichloro-6-(3-fluorophenyl)-N-propylpyridin-2-amine?
The InChIKey is CIEULLBPUABWFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13Cl2FN2/c1-2-6-18-14-12(16)8-11(15)13(19-14)9-4-3-5-10(17)7-9/h3-5,7-8H,2,6H2,1H3,(H,18,19).
What are the key properties of 3,5-dichloro-6-(3-fluorophenyl)-N-propylpyridin-2-amine?
3,5-dichloro-6-(3-fluorophenyl)-N-propylpyridin-2-amine has a molecular weight of 299.18 g/mol, XLogP of 5.02, 4 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-fluorophenyl)-N-propylpyridin-2-amine is sourced from PubChem (CID 102753089), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).