3,5-dichloro-6-(2,4-difluorophenoxy)-N-propylpyridin-2-amine

C14H12Cl2F2N2O — CID 102760578

IUPAC3,5-dichloro-6-(2,4-difluorophenoxy)-N-propylpyridin-2-amine
SMILESCCCNc1nc(Oc2ccc(F)cc2F)c(Cl)cc1Cl
InChIInChI=1S/C14H12Cl2F2N2O/c1-2-5-19-13-9(15)7-10(16)14(20-13)21-12-4-3-8(17)6-11(12)18/h3-4,6-7H,2,5H2,1H3,(H,19,20)
InChIKeyUJXYWBHSMBCQSH-UHFFFAOYSA-N
MW333.17 g/mol
LogP5.28
Rot. Bonds5

About 3,5-dichloro-6-(2,4-difluorophenoxy)-N-propylpyridin-2-amine

3,5-dichloro-6-(2,4-difluorophenoxy)-N-propylpyridin-2-amine (PubChem CID 102760578) has the molecular formula C14H12Cl2F2N2O and a molecular weight of 333.17 g/mol. Its IUPAC name is 3,5-dichloro-6-(2,4-difluorophenoxy)-N-propylpyridin-2-amine.

Molecular Properties

Compound Name3,5-dichloro-6-(2,4-difluorophenoxy)-N-propylpyridin-2-amine
PubChem CID102760578
Molecular FormulaC14H12Cl2F2N2O
Molecular Weight333.17 g/mol
Exact Mass332.03
IUPAC Name3,5-dichloro-6-(2,4-difluorophenoxy)-N-propylpyridin-2-amine
SMILESCCCNc1nc(Oc2ccc(F)cc2F)c(Cl)cc1Cl
InChIInChI=1S/C14H12Cl2F2N2O/c1-2-5-19-13-9(15)7-10(16)14(20-13)21-12-4-3-8(17)6-11(12)18/h3-4,6-7H,2,5H2,1H3,(H,19,20)
InChIKeyUJXYWBHSMBCQSH-UHFFFAOYSA-N
XLogP5.28
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500333.17
LogP ≤ 55.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3,5-dichloro-6-(5-fluoro-2-methylphenoxy)-N-propylpyridin-2-amine
CID 102989029
3,5-dichloro-6-(2,5-difluorophenyl)-N-propylpyridin-2-amine
CID 102753304
5-bromo-4-(2,4-difluorophenoxy)-N-propylpyrimidin-2-amine
CID 80862949
3,5-dichloro-6-N-(4-fluoro-2-iodophenyl)-2-N-propylpyridine-2,6-diamine
CID 102758994
3,5-dichloro-6-[(4-chlorophenyl)methoxy]-N-propylpyridin-2-amine
CID 102761015
3,5-dichloro-6-(3-fluorophenyl)-N-propylpyridin-2-amine
CID 102753089
3,5-dichloro-N-ethyl-6-(3-fluoro-4-methylphenoxy)pyridin-2-amine
CID 107171826
3,5-dichloro-6-(3-methylbutan-2-yloxy)-N-propylpyridin-2-amine
CID 102761074
6-(2,4-difluorophenoxy)-3-methyl-N-propyl-2H-pyrazolo[3,4-d]pyrimidin-4-amine;ethane
CID 143098687
3,5-dichloro-6-(3,4-difluorophenyl)-N-propylpyridin-2-amine
CID 102753267
3,5-dichloro-6-[3-(dimethylamino)propoxy]-N-propylpyridin-2-amine
CID 102760859
3,5-dichloro-6-N-(2-fluorophenyl)-2-N-propylpyridine-2,6-diamine
CID 102755165

Frequently Asked Questions

What is the IUPAC name of 3,5-dichloro-6-(2,4-difluorophenoxy)-N-propylpyridin-2-amine?
The IUPAC name of 3,5-dichloro-6-(2,4-difluorophenoxy)-N-propylpyridin-2-amine (CID 102760578) is 3,5-dichloro-6-(2,4-difluorophenoxy)-N-propylpyridin-2-amine.
What is the SMILES notation for 3,5-dichloro-6-(2,4-difluorophenoxy)-N-propylpyridin-2-amine?
The canonical SMILES for 3,5-dichloro-6-(2,4-difluorophenoxy)-N-propylpyridin-2-amine is CCCNc1nc(Oc2ccc(F)cc2F)c(Cl)cc1Cl.
What is the InChIKey of 3,5-dichloro-6-(2,4-difluorophenoxy)-N-propylpyridin-2-amine?
The InChIKey is UJXYWBHSMBCQSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12Cl2F2N2O/c1-2-5-19-13-9(15)7-10(16)14(20-13)21-12-4-3-8(17)6-11(12)18/h3-4,6-7H,2,5H2,1H3,(H,19,20).
What are the key properties of 3,5-dichloro-6-(2,4-difluorophenoxy)-N-propylpyridin-2-amine?
3,5-dichloro-6-(2,4-difluorophenoxy)-N-propylpyridin-2-amine has a molecular weight of 333.17 g/mol, XLogP of 5.28, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dichloro-6-(2,4-difluorophenoxy)-N-propylpyridin-2-amine is sourced from PubChem (CID 102760578), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).