3,5,6-trifluoro-N-(2-fluoroethyl)pyridin-2-amine

C7H6F4N2 — CID 130504829

IUPAC3,5,6-trifluoro-N-(2-fluoroethyl)pyridin-2-amine
SMILESFCCNc1nc(F)c(F)cc1F
InChIInChI=1S/C7H6F4N2/c8-1-2-12-7-5(10)3-4(9)6(11)13-7/h3H,1-2H2,(H,12,13)
InChIKeySYLZDVSHZAHFHR-UHFFFAOYSA-N
MW194.13 g/mol
LogP1.88
Rot. Bonds3

About 3,5,6-trifluoro-N-(2-fluoroethyl)pyridin-2-amine

3,5,6-trifluoro-N-(2-fluoroethyl)pyridin-2-amine (PubChem CID 130504829) has the molecular formula C7H6F4N2 and a molecular weight of 194.13 g/mol. Its IUPAC name is 3,5,6-trifluoro-N-(2-fluoroethyl)pyridin-2-amine.

Molecular Properties

Compound Name3,5,6-trifluoro-N-(2-fluoroethyl)pyridin-2-amine
PubChem CID130504829
Molecular FormulaC7H6F4N2
Molecular Weight194.13 g/mol
Exact Mass194.05
IUPAC Name3,5,6-trifluoro-N-(2-fluoroethyl)pyridin-2-amine
SMILESFCCNc1nc(F)c(F)cc1F
InChIInChI=1S/C7H6F4N2/c8-1-2-12-7-5(10)3-4(9)6(11)13-7/h3H,1-2H2,(H,12,13)
InChIKeySYLZDVSHZAHFHR-UHFFFAOYSA-N
XLogP1.88
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.13
LogP ≤ 51.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Related Compounds

3,5,6-trifluoro-N-(2-phenylethyl)pyridin-2-amine
CID 114072372
3,5,6-trifluoro-N-pent-4-ynylpyridin-2-amine
CID 106223086
3,5,6-trifluoro-N-(4-propan-2-yloxybutyl)pyridin-2-amine
CID 106013715
N-tert-butyl-3-[(3,5,6-trifluoro-2-pyridinyl)amino]propanamide
CID 114072681
5-chloro-3-fluoro-N-(2-fluoroethyl)pyridin-2-amine
CID 130478073
N-tert-butyl-2-[(3,5,6-trifluoro-2-pyridinyl)amino]acetamide
CID 114072648
N-[(2,2-dimethyl-1,3-dioxolan-4-yl)methyl]-3,5,6-trifluoropyridin-2-amine
CID 114156912
N-(2,4-difluorophenyl)-3,5,6-trifluoropyridin-2-amine
CID 114072340
3,5-difluoro-6-N-octylpyridine-2,6-diamine
CID 114074590
3,5,6-trifluoro-N-[(3-methoxyoxolan-3-yl)methyl]pyridin-2-amine
CID 114072689
N-(4-bromo-3-fluorophenyl)-3,5,6-trifluoropyridin-2-amine
CID 114072596
2-[[3,5-difluoro-6-(propylamino)-2-pyridinyl]amino]acetamide
CID 114074035

Frequently Asked Questions

What is the IUPAC name of 3,5,6-trifluoro-N-(2-fluoroethyl)pyridin-2-amine?
The IUPAC name of 3,5,6-trifluoro-N-(2-fluoroethyl)pyridin-2-amine (CID 130504829) is 3,5,6-trifluoro-N-(2-fluoroethyl)pyridin-2-amine.
What is the SMILES notation for 3,5,6-trifluoro-N-(2-fluoroethyl)pyridin-2-amine?
The canonical SMILES for 3,5,6-trifluoro-N-(2-fluoroethyl)pyridin-2-amine is FCCNc1nc(F)c(F)cc1F.
What is the InChIKey of 3,5,6-trifluoro-N-(2-fluoroethyl)pyridin-2-amine?
The InChIKey is SYLZDVSHZAHFHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H6F4N2/c8-1-2-12-7-5(10)3-4(9)6(11)13-7/h3H,1-2H2,(H,12,13).
What are the key properties of 3,5,6-trifluoro-N-(2-fluoroethyl)pyridin-2-amine?
3,5,6-trifluoro-N-(2-fluoroethyl)pyridin-2-amine has a molecular weight of 194.13 g/mol, XLogP of 1.88, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5,6-trifluoro-N-(2-fluoroethyl)pyridin-2-amine is sourced from PubChem (CID 130504829), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).