5-chloro-6-(2,2-difluoroethoxymethyl)-N-ethylpyridin-2-amine

C10H13ClF2N2O — CID 82005693

IUPAC5-chloro-6-(2,2-difluoroethoxymethyl)-N-ethylpyridin-2-amine
SMILESCCNc1ccc(Cl)c(COCC(F)F)n1
InChIInChI=1S/C10H13ClF2N2O/c1-2-14-10-4-3-7(11)8(15-10)5-16-6-9(12)13/h3-4,9H,2,5-6H2,1H3,(H,14,15)
InChIKeyFHAGRFSUMFTQIW-UHFFFAOYSA-N
MW250.68 g/mol
LogP2.95
Rot. Bonds6

About 5-chloro-6-(2,2-difluoroethoxymethyl)-N-ethylpyridin-2-amine

5-chloro-6-(2,2-difluoroethoxymethyl)-N-ethylpyridin-2-amine (PubChem CID 82005693) has the molecular formula C10H13ClF2N2O and a molecular weight of 250.68 g/mol. Its IUPAC name is 5-chloro-6-(2,2-difluoroethoxymethyl)-N-ethylpyridin-2-amine.

Molecular Properties

Compound Name5-chloro-6-(2,2-difluoroethoxymethyl)-N-ethylpyridin-2-amine
PubChem CID82005693
Molecular FormulaC10H13ClF2N2O
Molecular Weight250.68 g/mol
Exact Mass250.07
IUPAC Name5-chloro-6-(2,2-difluoroethoxymethyl)-N-ethylpyridin-2-amine
SMILESCCNc1ccc(Cl)c(COCC(F)F)n1
InChIInChI=1S/C10H13ClF2N2O/c1-2-14-10-4-3-7(11)8(15-10)5-16-6-9(12)13/h3-4,9H,2,5-6H2,1H3,(H,14,15)
InChIKeyFHAGRFSUMFTQIW-UHFFFAOYSA-N
XLogP2.95
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.68
LogP ≤ 52.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-chloro-N-ethyl-6-[2-(2-methylpropoxy)ethoxymethyl]pyridin-2-amine
CID 106449250
5-chloro-N-ethyl-6-(4-methylpentoxymethyl)pyridin-2-amine
CID 62885644
6-[(4-bromophenyl)methoxymethyl]-5-chloro-N-ethylpyridin-2-amine
CID 82831291
5-chloro-N-methyl-6-(2-methylpropoxymethyl)pyridin-2-amine
CID 62886167
5-chloro-N-ethyl-6-[(4-fluorophenoxy)methyl]pyridin-2-amine
CID 62885461
5-chloro-N-ethyl-6-(1-phenylethoxymethyl)pyridin-2-amine
CID 62885810
5-chloro-6-[(2,6-dibromophenoxy)methyl]-N-ethylpyridin-2-amine
CID 63485313
5-chloro-N-ethyl-6-[(2-methylsulfanylphenoxy)methyl]pyridin-2-amine
CID 63649715
5-chloro-N-ethyl-6-[(2,3,5-trimethylphenoxy)methyl]pyridin-2-amine
CID 63484955
6-[(4-bromo-2-fluorophenoxy)methyl]-5-chloro-N-ethylpyridin-2-amine
CID 63485322
5-chloro-N-ethyl-6-[[ethyl(propan-2-yl)amino]methyl]pyridin-2-amine
CID 62890418
5-chloro-6-[(2,5-dimethylphenoxy)methyl]-N-ethylpyridin-2-amine
CID 63484940

Frequently Asked Questions

What is the IUPAC name of 5-chloro-6-(2,2-difluoroethoxymethyl)-N-ethylpyridin-2-amine?
The IUPAC name of 5-chloro-6-(2,2-difluoroethoxymethyl)-N-ethylpyridin-2-amine (CID 82005693) is 5-chloro-6-(2,2-difluoroethoxymethyl)-N-ethylpyridin-2-amine.
What is the SMILES notation for 5-chloro-6-(2,2-difluoroethoxymethyl)-N-ethylpyridin-2-amine?
The canonical SMILES for 5-chloro-6-(2,2-difluoroethoxymethyl)-N-ethylpyridin-2-amine is CCNc1ccc(Cl)c(COCC(F)F)n1.
What is the InChIKey of 5-chloro-6-(2,2-difluoroethoxymethyl)-N-ethylpyridin-2-amine?
The InChIKey is FHAGRFSUMFTQIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13ClF2N2O/c1-2-14-10-4-3-7(11)8(15-10)5-16-6-9(12)13/h3-4,9H,2,5-6H2,1H3,(H,14,15).
What are the key properties of 5-chloro-6-(2,2-difluoroethoxymethyl)-N-ethylpyridin-2-amine?
5-chloro-6-(2,2-difluoroethoxymethyl)-N-ethylpyridin-2-amine has a molecular weight of 250.68 g/mol, XLogP of 2.95, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-6-(2,2-difluoroethoxymethyl)-N-ethylpyridin-2-amine is sourced from PubChem (CID 82005693), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).