2-(cyclopropylmethoxy)-6-(2,2,2-trifluoroethoxy)pyridin-3-amine

C11H13F3N2O2 — CID 43261927

IUPAC2-(cyclopropylmethoxy)-6-(2,2,2-trifluoroethoxy)pyridin-3-amine
SMILESNc1ccc(OCC(F)(F)F)nc1OCC1CC1
InChIInChI=1S/C11H13F3N2O2/c12-11(13,14)6-18-9-4-3-8(15)10(16-9)17-5-7-1-2-7/h3-4,7H,1-2,5-6,15H2
InChIKeyIDUMRYGJPFGZFH-UHFFFAOYSA-N
MW262.23 g/mol
LogP2.39
Rot. Bonds5

About 2-(cyclopropylmethoxy)-6-(2,2,2-trifluoroethoxy)pyridin-3-amine

2-(cyclopropylmethoxy)-6-(2,2,2-trifluoroethoxy)pyridin-3-amine (PubChem CID 43261927) has the molecular formula C11H13F3N2O2 and a molecular weight of 262.23 g/mol. Its IUPAC name is 2-(cyclopropylmethoxy)-6-(2,2,2-trifluoroethoxy)pyridin-3-amine.

Molecular Properties

Compound Name2-(cyclopropylmethoxy)-6-(2,2,2-trifluoroethoxy)pyridin-3-amine
PubChem CID43261927
Molecular FormulaC11H13F3N2O2
Molecular Weight262.23 g/mol
Exact Mass262.09
IUPAC Name2-(cyclopropylmethoxy)-6-(2,2,2-trifluoroethoxy)pyridin-3-amine
SMILESNc1ccc(OCC(F)(F)F)nc1OCC1CC1
InChIInChI=1S/C11H13F3N2O2/c12-11(13,14)6-18-9-4-3-8(15)10(16-9)17-5-7-1-2-7/h3-4,7H,1-2,5-6,15H2
InChIKeyIDUMRYGJPFGZFH-UHFFFAOYSA-N
XLogP2.39
TPSA57.37 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.23
LogP ≤ 52.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(cyclopropylmethoxy)-6-(2,2,2-trifluoroethoxy)pyridin-3-amine?
The IUPAC name of 2-(cyclopropylmethoxy)-6-(2,2,2-trifluoroethoxy)pyridin-3-amine (CID 43261927) is 2-(cyclopropylmethoxy)-6-(2,2,2-trifluoroethoxy)pyridin-3-amine.
What is the SMILES notation for 2-(cyclopropylmethoxy)-6-(2,2,2-trifluoroethoxy)pyridin-3-amine?
The canonical SMILES for 2-(cyclopropylmethoxy)-6-(2,2,2-trifluoroethoxy)pyridin-3-amine is Nc1ccc(OCC(F)(F)F)nc1OCC1CC1.
What is the InChIKey of 2-(cyclopropylmethoxy)-6-(2,2,2-trifluoroethoxy)pyridin-3-amine?
The InChIKey is IDUMRYGJPFGZFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13F3N2O2/c12-11(13,14)6-18-9-4-3-8(15)10(16-9)17-5-7-1-2-7/h3-4,7H,1-2,5-6,15H2.
What are the key properties of 2-(cyclopropylmethoxy)-6-(2,2,2-trifluoroethoxy)pyridin-3-amine?
2-(cyclopropylmethoxy)-6-(2,2,2-trifluoroethoxy)pyridin-3-amine has a molecular weight of 262.23 g/mol, XLogP of 2.39, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopropylmethoxy)-6-(2,2,2-trifluoroethoxy)pyridin-3-amine is sourced from PubChem (CID 43261927), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).