3-propan-2-yloxy-N-(2,2,3,3-tetrafluoropropyl)pyridin-2-amine

C11H14F4N2O — CID 114169605

IUPAC3-propan-2-yloxy-N-(2,2,3,3-tetrafluoropropyl)pyridin-2-amine
SMILESCC(C)Oc1cccnc1NCC(F)(F)C(F)F
InChIInChI=1S/C11H14F4N2O/c1-7(2)18-8-4-3-5-16-9(8)17-6-11(14,15)10(12)13/h3-5,7,10H,6H2,1-2H3,(H,16,17)
InChIKeyRANAMLMLBWMTRB-UHFFFAOYSA-N
MW266.24 g/mol
LogP3.18
Rot. Bonds6

About 3-propan-2-yloxy-N-(2,2,3,3-tetrafluoropropyl)pyridin-2-amine

3-propan-2-yloxy-N-(2,2,3,3-tetrafluoropropyl)pyridin-2-amine (PubChem CID 114169605) has the molecular formula C11H14F4N2O and a molecular weight of 266.24 g/mol. Its IUPAC name is 3-propan-2-yloxy-N-(2,2,3,3-tetrafluoropropyl)pyridin-2-amine.

Molecular Properties

Compound Name3-propan-2-yloxy-N-(2,2,3,3-tetrafluoropropyl)pyridin-2-amine
PubChem CID114169605
Molecular FormulaC11H14F4N2O
Molecular Weight266.24 g/mol
Exact Mass266.10
IUPAC Name3-propan-2-yloxy-N-(2,2,3,3-tetrafluoropropyl)pyridin-2-amine
SMILESCC(C)Oc1cccnc1NCC(F)(F)C(F)F
InChIInChI=1S/C11H14F4N2O/c1-7(2)18-8-4-3-5-16-9(8)17-6-11(14,15)10(12)13/h3-5,7,10H,6H2,1-2H3,(H,16,17)
InChIKeyRANAMLMLBWMTRB-UHFFFAOYSA-N
XLogP3.18
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.24
LogP ≤ 53.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Perfluorinated_chain', 'substructure': 'N/A'}

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Related Compounds

N-(3-methyl-2-propan-2-ylbutyl)-3-propan-2-yloxypyridin-2-amine
CID 102914136
3-propan-2-yloxy-N-(2-propan-2-yloxyethyl)pyridin-2-amine
CID 113450392
N-[(4-ethylphenyl)methyl]-3-propan-2-yloxypyridin-2-amine
CID 106900068
1-N-(3-propan-2-yloxy-2-pyridinyl)pentane-1,4-diamine
CID 106127389
3-ethoxy-N-(2,2,3-trimethylbutyl)pyridin-2-amine
CID 114100789
3-nitro-N-(2,2,3,3-tetrafluoropropyl)pyridin-2-amine
CID 106293565
N-[(3-fluorophenyl)methyl]-3-propan-2-yloxypyridin-2-amine
CID 112547893
3-ethyl-1-[(3-propan-2-yloxy-2-pyridinyl)amino]pentan-2-ol
CID 106287839
N-(2-methylpentan-3-yl)-3-propan-2-yloxypyridin-2-amine
CID 113370845
N,N-dimethyl-2-[(3-propan-2-yloxy-2-pyridinyl)amino]ethanesulfonamide
CID 106338931
3-propan-2-yloxy-2-(2,2,2-trifluoroethoxy)pyridine
CID 164741273
N-[2-(5-chlorothiophen-2-yl)ethyl]-3-propan-2-yloxypyridin-2-amine
CID 106048859

Frequently Asked Questions

What is the IUPAC name of 3-propan-2-yloxy-N-(2,2,3,3-tetrafluoropropyl)pyridin-2-amine?
The IUPAC name of 3-propan-2-yloxy-N-(2,2,3,3-tetrafluoropropyl)pyridin-2-amine (CID 114169605) is 3-propan-2-yloxy-N-(2,2,3,3-tetrafluoropropyl)pyridin-2-amine.
What is the SMILES notation for 3-propan-2-yloxy-N-(2,2,3,3-tetrafluoropropyl)pyridin-2-amine?
The canonical SMILES for 3-propan-2-yloxy-N-(2,2,3,3-tetrafluoropropyl)pyridin-2-amine is CC(C)Oc1cccnc1NCC(F)(F)C(F)F.
What is the InChIKey of 3-propan-2-yloxy-N-(2,2,3,3-tetrafluoropropyl)pyridin-2-amine?
The InChIKey is RANAMLMLBWMTRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14F4N2O/c1-7(2)18-8-4-3-5-16-9(8)17-6-11(14,15)10(12)13/h3-5,7,10H,6H2,1-2H3,(H,16,17).
What are the key properties of 3-propan-2-yloxy-N-(2,2,3,3-tetrafluoropropyl)pyridin-2-amine?
3-propan-2-yloxy-N-(2,2,3,3-tetrafluoropropyl)pyridin-2-amine has a molecular weight of 266.24 g/mol, XLogP of 3.18, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-propan-2-yloxy-N-(2,2,3,3-tetrafluoropropyl)pyridin-2-amine is sourced from PubChem (CID 114169605), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).