N-(3-propan-2-ylcyclobutyl)-6-(2,2,2-trifluoroethoxy)pyridin-3-amine

C14H19F3N2O — CID 103561117

IUPACN-(3-propan-2-ylcyclobutyl)-6-(2,2,2-trifluoroethoxy)pyridin-3-amine
SMILESCC(C)C1CC(Nc2ccc(OCC(F)(F)F)nc2)C1
InChIInChI=1S/C14H19F3N2O/c1-9(2)10-5-12(6-10)19-11-3-4-13(18-7-11)20-8-14(15,16)17/h3-4,7,9-10,12,19H,5-6,8H2,1-2H3
InChIKeyUGDZIPNPMJSMKA-UHFFFAOYSA-N
MW288.31 g/mol
LogP3.87
Rot. Bonds5

About N-(3-propan-2-ylcyclobutyl)-6-(2,2,2-trifluoroethoxy)pyridin-3-amine

N-(3-propan-2-ylcyclobutyl)-6-(2,2,2-trifluoroethoxy)pyridin-3-amine (PubChem CID 103561117) has the molecular formula C14H19F3N2O and a molecular weight of 288.31 g/mol. Its IUPAC name is N-(3-propan-2-ylcyclobutyl)-6-(2,2,2-trifluoroethoxy)pyridin-3-amine.

Molecular Properties

Compound NameN-(3-propan-2-ylcyclobutyl)-6-(2,2,2-trifluoroethoxy)pyridin-3-amine
PubChem CID103561117
Molecular FormulaC14H19F3N2O
Molecular Weight288.31 g/mol
Exact Mass288.14
IUPAC NameN-(3-propan-2-ylcyclobutyl)-6-(2,2,2-trifluoroethoxy)pyridin-3-amine
SMILESCC(C)C1CC(Nc2ccc(OCC(F)(F)F)nc2)C1
InChIInChI=1S/C14H19F3N2O/c1-9(2)10-5-12(6-10)19-11-3-4-13(18-7-11)20-8-14(15,16)17/h3-4,7,9-10,12,19H,5-6,8H2,1-2H3
InChIKeyUGDZIPNPMJSMKA-UHFFFAOYSA-N
XLogP3.87
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.31
LogP ≤ 53.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-cyclohexyl-6-(2,2,2-trifluoroethoxy)pyridin-3-amine
CID 43677195
N-(3,4-dimethylcyclohexyl)-6-(2,2,2-trifluoroethoxy)pyridin-3-amine
CID 64733194
N-(3-ethylcyclopentyl)-6-(2,2,2-trifluoroethoxy)pyridin-3-amine
CID 64501049
N-(3,3-dimethylcyclopentyl)-6-(2,2,2-trifluoroethoxy)pyridin-3-amine
CID 80693595
N-[6-(2,2,2-trifluoroethoxy)-3-pyridinyl]azepan-4-amine
CID 103981038
N-ethyl-6-(2,2,2-trifluoroethoxy)pyridin-3-amine;hydrochloride
CID 174836554
N-(2-methylthiolan-3-yl)-6-(2,2,2-trifluoroethoxy)pyridin-3-amine
CID 102671229
N-[6-(2,2,2-trifluoroethoxy)-3-pyridinyl]propane-2-sulfonamide
CID 62998761
N-(cyclopentylmethyl)-6-(2,2,2-trifluoroethoxy)pyridin-3-amine
CID 55030411
1-[6-(2,2,2-trifluoroethoxy)-3-pyridinyl]ethanamine
CID 58629100
N-[6-(2,2,2-trifluoroethoxy)-3-pyridinyl]methanesulfonamide
CID 61063335
N-(1-pyrrolidin-2-ylpropan-2-yl)-6-(2,2,2-trifluoroethoxy)pyridin-3-amine
CID 79537456

Frequently Asked Questions

What is the IUPAC name of N-(3-propan-2-ylcyclobutyl)-6-(2,2,2-trifluoroethoxy)pyridin-3-amine?
The IUPAC name of N-(3-propan-2-ylcyclobutyl)-6-(2,2,2-trifluoroethoxy)pyridin-3-amine (CID 103561117) is N-(3-propan-2-ylcyclobutyl)-6-(2,2,2-trifluoroethoxy)pyridin-3-amine.
What is the SMILES notation for N-(3-propan-2-ylcyclobutyl)-6-(2,2,2-trifluoroethoxy)pyridin-3-amine?
The canonical SMILES for N-(3-propan-2-ylcyclobutyl)-6-(2,2,2-trifluoroethoxy)pyridin-3-amine is CC(C)C1CC(Nc2ccc(OCC(F)(F)F)nc2)C1.
What is the InChIKey of N-(3-propan-2-ylcyclobutyl)-6-(2,2,2-trifluoroethoxy)pyridin-3-amine?
The InChIKey is UGDZIPNPMJSMKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19F3N2O/c1-9(2)10-5-12(6-10)19-11-3-4-13(18-7-11)20-8-14(15,16)17/h3-4,7,9-10,12,19H,5-6,8H2,1-2H3.
What are the key properties of N-(3-propan-2-ylcyclobutyl)-6-(2,2,2-trifluoroethoxy)pyridin-3-amine?
N-(3-propan-2-ylcyclobutyl)-6-(2,2,2-trifluoroethoxy)pyridin-3-amine has a molecular weight of 288.31 g/mol, XLogP of 3.87, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-propan-2-ylcyclobutyl)-6-(2,2,2-trifluoroethoxy)pyridin-3-amine is sourced from PubChem (CID 103561117), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).