3,5-dichloro-N-ethyl-6-(3-fluoro-4-methylphenoxy)pyridin-2-amine

C14H13Cl2FN2O — CID 107171826

IUPAC3,5-dichloro-N-ethyl-6-(3-fluoro-4-methylphenoxy)pyridin-2-amine
SMILESCCNc1nc(Oc2ccc(C)c(F)c2)c(Cl)cc1Cl
InChIInChI=1S/C14H13Cl2FN2O/c1-3-18-13-10(15)7-11(16)14(19-13)20-9-5-4-8(2)12(17)6-9/h4-7H,3H2,1-2H3,(H,18,19)
InChIKeyMCMVIWCDXISRQG-UHFFFAOYSA-N
MW315.18 g/mol
LogP5.06
Rot. Bonds4

About 3,5-dichloro-N-ethyl-6-(3-fluoro-4-methylphenoxy)pyridin-2-amine

3,5-dichloro-N-ethyl-6-(3-fluoro-4-methylphenoxy)pyridin-2-amine (PubChem CID 107171826) has the molecular formula C14H13Cl2FN2O and a molecular weight of 315.18 g/mol. Its IUPAC name is 3,5-dichloro-N-ethyl-6-(3-fluoro-4-methylphenoxy)pyridin-2-amine.

Molecular Properties

Compound Name3,5-dichloro-N-ethyl-6-(3-fluoro-4-methylphenoxy)pyridin-2-amine
PubChem CID107171826
Molecular FormulaC14H13Cl2FN2O
Molecular Weight315.18 g/mol
Exact Mass314.04
IUPAC Name3,5-dichloro-N-ethyl-6-(3-fluoro-4-methylphenoxy)pyridin-2-amine
SMILESCCNc1nc(Oc2ccc(C)c(F)c2)c(Cl)cc1Cl
InChIInChI=1S/C14H13Cl2FN2O/c1-3-18-13-10(15)7-11(16)14(19-13)20-9-5-4-8(2)12(17)6-9/h4-7H,3H2,1-2H3,(H,18,19)
InChIKeyMCMVIWCDXISRQG-UHFFFAOYSA-N
XLogP5.06
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500315.18
LogP ≤ 55.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3,5-dichloro-6-(3-fluoro-4-methylphenoxy)-N-methylpyridin-2-amine
CID 107171841
3,5-dichloro-N-ethyl-6-(3-methylphenoxy)pyridin-2-amine
CID 102760660
N-ethyl-6-(3-fluoro-4-methylphenoxy)-5-methoxypyrimidin-4-amine
CID 107171811
N-ethyl-6-(3-fluoro-4-methylphenoxy)-5-propan-2-ylpyrimidin-4-amine
CID 107171713
3,5-dichloro-6-(5-fluoro-2-methylphenoxy)-N-propylpyridin-2-amine
CID 102989029
N-ethyl-6-(3-fluoro-4-methylphenoxy)-5-nitropyridin-2-amine
CID 107171732
4-chloro-6-(3-fluoro-4-methylphenoxy)-5-methyl-2-propylpyrimidine
CID 107169178
3,5-dichloro-N-ethyl-6-methylpyridin-2-amine
CID 102753093
3,5-dichloro-6-(2,4-difluorophenoxy)-N-propylpyridin-2-amine
CID 102760578
6-(4-chloro-3-fluorophenoxy)-2,5-dimethyl-N-propylpyrimidin-4-amine
CID 82717795
2-tert-butyl-4-chloro-6-(3-fluoro-4-methylphenoxy)-5-methylpyrimidine
CID 107169151
[5-chloro-6-(3-fluoro-4-methylphenoxy)-3-pyridinyl]methanol
CID 107170106

Frequently Asked Questions

What is the IUPAC name of 3,5-dichloro-N-ethyl-6-(3-fluoro-4-methylphenoxy)pyridin-2-amine?
The IUPAC name of 3,5-dichloro-N-ethyl-6-(3-fluoro-4-methylphenoxy)pyridin-2-amine (CID 107171826) is 3,5-dichloro-N-ethyl-6-(3-fluoro-4-methylphenoxy)pyridin-2-amine.
What is the SMILES notation for 3,5-dichloro-N-ethyl-6-(3-fluoro-4-methylphenoxy)pyridin-2-amine?
The canonical SMILES for 3,5-dichloro-N-ethyl-6-(3-fluoro-4-methylphenoxy)pyridin-2-amine is CCNc1nc(Oc2ccc(C)c(F)c2)c(Cl)cc1Cl.
What is the InChIKey of 3,5-dichloro-N-ethyl-6-(3-fluoro-4-methylphenoxy)pyridin-2-amine?
The InChIKey is MCMVIWCDXISRQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13Cl2FN2O/c1-3-18-13-10(15)7-11(16)14(19-13)20-9-5-4-8(2)12(17)6-9/h4-7H,3H2,1-2H3,(H,18,19).
What are the key properties of 3,5-dichloro-N-ethyl-6-(3-fluoro-4-methylphenoxy)pyridin-2-amine?
3,5-dichloro-N-ethyl-6-(3-fluoro-4-methylphenoxy)pyridin-2-amine has a molecular weight of 315.18 g/mol, XLogP of 5.06, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dichloro-N-ethyl-6-(3-fluoro-4-methylphenoxy)pyridin-2-amine is sourced from PubChem (CID 107171826), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).