6-(3-chlorophenoxy)-N-ethyl-4-(trifluoromethyl)pyridin-2-amine

C14H12ClF3N2O — CID 102719846

IUPAC6-(3-chlorophenoxy)-N-ethyl-4-(trifluoromethyl)pyridin-2-amine
SMILESCCNc1cc(C(F)(F)F)cc(Oc2cccc(Cl)c2)n1
InChIInChI=1S/C14H12ClF3N2O/c1-2-19-12-6-9(14(16,17)18)7-13(20-12)21-11-5-3-4-10(15)8-11/h3-8H,2H2,1H3,(H,19,20)
InChIKeyHNTOPKPVLXRSGB-UHFFFAOYSA-N
MW316.71 g/mol
LogP4.98
Rot. Bonds4

About 6-(3-chlorophenoxy)-N-ethyl-4-(trifluoromethyl)pyridin-2-amine

6-(3-chlorophenoxy)-N-ethyl-4-(trifluoromethyl)pyridin-2-amine (PubChem CID 102719846) has the molecular formula C14H12ClF3N2O and a molecular weight of 316.71 g/mol. Its IUPAC name is 6-(3-chlorophenoxy)-N-ethyl-4-(trifluoromethyl)pyridin-2-amine.

Molecular Properties

Compound Name6-(3-chlorophenoxy)-N-ethyl-4-(trifluoromethyl)pyridin-2-amine
PubChem CID102719846
Molecular FormulaC14H12ClF3N2O
Molecular Weight316.71 g/mol
Exact Mass316.06
IUPAC Name6-(3-chlorophenoxy)-N-ethyl-4-(trifluoromethyl)pyridin-2-amine
SMILESCCNc1cc(C(F)(F)F)cc(Oc2cccc(Cl)c2)n1
InChIInChI=1S/C14H12ClF3N2O/c1-2-19-12-6-9(14(16,17)18)7-13(20-12)21-11-5-3-4-10(15)8-11/h3-8H,2H2,1H3,(H,19,20)
InChIKeyHNTOPKPVLXRSGB-UHFFFAOYSA-N
XLogP4.98
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.71
LogP ≤ 54.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-ethyl-6-(4-iodophenoxy)-4-(trifluoromethyl)pyridin-2-amine
CID 102719878
N-ethyl-2-methyl-6-[3-(trifluoromethyl)phenoxy]pyrimidin-4-amine
CID 80874519
2-chloro-6-(3-ethoxyphenoxy)-4-(trifluoromethyl)pyridine
CID 102715253
N-ethyl-6-[(2-methylpropan-2-yl)oxy]-4-(trifluoromethyl)pyridin-2-amine
CID 102719643
[6-(3-methylphenoxy)-4-(trifluoromethyl)-2-pyridinyl]hydrazine
CID 102721263
6-(3-chlorophenoxy)-4-N-propylpyrimidine-2,4-diamine
CID 80870090
6-N-(4-chlorophenyl)-2-N-ethyl-4-(trifluoromethyl)pyridine-2,6-diamine
CID 102717083
4-N-ethyl-6-(3-fluorophenoxy)pyrimidine-2,4-diamine
CID 80870028
2-chloro-6-(3-fluorophenoxy)-4-(trifluoromethyl)pyridine
CID 102715210
6-(3,4-dichlorophenoxy)-N-ethylpyridin-2-amine
CID 80874477
6-(3-ethoxyphenoxy)-N-ethylpyridin-2-amine
CID 80873339
N-[[6-(3-chlorophenoxy)-2-pyridinyl]methyl]ethanamine
CID 62323929

Frequently Asked Questions

What is the IUPAC name of 6-(3-chlorophenoxy)-N-ethyl-4-(trifluoromethyl)pyridin-2-amine?
The IUPAC name of 6-(3-chlorophenoxy)-N-ethyl-4-(trifluoromethyl)pyridin-2-amine (CID 102719846) is 6-(3-chlorophenoxy)-N-ethyl-4-(trifluoromethyl)pyridin-2-amine.
What is the SMILES notation for 6-(3-chlorophenoxy)-N-ethyl-4-(trifluoromethyl)pyridin-2-amine?
The canonical SMILES for 6-(3-chlorophenoxy)-N-ethyl-4-(trifluoromethyl)pyridin-2-amine is CCNc1cc(C(F)(F)F)cc(Oc2cccc(Cl)c2)n1.
What is the InChIKey of 6-(3-chlorophenoxy)-N-ethyl-4-(trifluoromethyl)pyridin-2-amine?
The InChIKey is HNTOPKPVLXRSGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12ClF3N2O/c1-2-19-12-6-9(14(16,17)18)7-13(20-12)21-11-5-3-4-10(15)8-11/h3-8H,2H2,1H3,(H,19,20).
What are the key properties of 6-(3-chlorophenoxy)-N-ethyl-4-(trifluoromethyl)pyridin-2-amine?
6-(3-chlorophenoxy)-N-ethyl-4-(trifluoromethyl)pyridin-2-amine has a molecular weight of 316.71 g/mol, XLogP of 4.98, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(3-chlorophenoxy)-N-ethyl-4-(trifluoromethyl)pyridin-2-amine is sourced from PubChem (CID 102719846), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).