2-N,2-dimethyl-3-(trifluoromethyl)-1H-pyridine-2,6-diamine

C8H12F3N3 — CID 154271649

IUPAC2-N,2-dimethyl-3-(trifluoromethyl)-1H-pyridine-2,6-diamine
SMILESCNC1(C)NC(N)=CC=C1C(F)(F)F
InChIInChI=1S/C8H12F3N3/c1-7(13-2)5(8(9,10)11)3-4-6(12)14-7/h3-4,13-14H,12H2,1-2H3
InChIKeyZGRYFNJSFBSFCE-UHFFFAOYSA-N
MW207.20 g/mol
LogP0.81
Rot. Bonds1

About 2-N,2-dimethyl-3-(trifluoromethyl)-1H-pyridine-2,6-diamine

2-N,2-dimethyl-3-(trifluoromethyl)-1H-pyridine-2,6-diamine (PubChem CID 154271649) has the molecular formula C8H12F3N3 and a molecular weight of 207.20 g/mol. Its IUPAC name is 2-N,2-dimethyl-3-(trifluoromethyl)-1H-pyridine-2,6-diamine.

Molecular Properties

Compound Name2-N,2-dimethyl-3-(trifluoromethyl)-1H-pyridine-2,6-diamine
PubChem CID154271649
Molecular FormulaC8H12F3N3
Molecular Weight207.20 g/mol
Exact Mass207.10
IUPAC Name2-N,2-dimethyl-3-(trifluoromethyl)-1H-pyridine-2,6-diamine
SMILESCNC1(C)NC(N)=CC=C1C(F)(F)F
InChIInChI=1S/C8H12F3N3/c1-7(13-2)5(8(9,10)11)3-4-6(12)14-7/h3-4,13-14H,12H2,1-2H3
InChIKeyZGRYFNJSFBSFCE-UHFFFAOYSA-N
XLogP0.81
TPSA50.08 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.20
LogP ≤ 50.81
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-ethyl-5-(trifluoromethyl)-1,2-dihydropyridin-2-amine
CID 131970485
N-ethyl-3-(trifluoromethyl)-1,2-dihydropyridin-6-amine
CID 137468108
(2E)-4-fluoro-3-methyl-2-(6-methylidene-2,3-dihydro-1H-pyrimidin-4-yl)penta-2,4-dien-1-amine
CID 144790040
(Z)-3-methyl-1-N-propan-2-yl-1-N'-[(3E,5Z)-8,8,8-trifluoro-3-methylocta-3,5-dien-2-yl]but-1-ene-1,1-diamine
CID 146583215
2-methyl-3-(trifluoromethyl)-1H-pyridine-2,6-diamine
CID 154264731
(3R,4Z)-N-ethyl-3-methyl-4-(2,2,2-trifluoroethylidene)-2,3-dihydro-1H-pyridin-6-amine
CID 164103160
2-N,1-dimethyl-6-methylidene-5-(trifluoromethyl)pyridine-2,3-diamine
CID 167035206
4-bromo-N,2-dimethyl-3-(trifluoromethyl)-1H-pyridin-2-amine
CID 172698370
2-methyl-3-(trifluoromethyl)-1H-pyridin-2-amine
CID 172777606
2-methyl-2-N-(2,2,2-trifluoroethyl)-1H-pyridine-2,6-diamine
CID 150959017
2-N'-ethyl-3-(2,2,2-trifluoroethyl)-1H-pyridine-2,2-diamine
CID 151032650
(1E,3E)-1-N'-propyl-4-(trifluoromethyl)hexa-1,3-diene-1,1-diamine
CID 162563285

Frequently Asked Questions

What is the IUPAC name of 2-N,2-dimethyl-3-(trifluoromethyl)-1H-pyridine-2,6-diamine?
The IUPAC name of 2-N,2-dimethyl-3-(trifluoromethyl)-1H-pyridine-2,6-diamine (CID 154271649) is 2-N,2-dimethyl-3-(trifluoromethyl)-1H-pyridine-2,6-diamine.
What is the SMILES notation for 2-N,2-dimethyl-3-(trifluoromethyl)-1H-pyridine-2,6-diamine?
The canonical SMILES for 2-N,2-dimethyl-3-(trifluoromethyl)-1H-pyridine-2,6-diamine is CNC1(C)NC(N)=CC=C1C(F)(F)F.
What is the InChIKey of 2-N,2-dimethyl-3-(trifluoromethyl)-1H-pyridine-2,6-diamine?
The InChIKey is ZGRYFNJSFBSFCE-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12F3N3/c1-7(13-2)5(8(9,10)11)3-4-6(12)14-7/h3-4,13-14H,12H2,1-2H3.
What are the key properties of 2-N,2-dimethyl-3-(trifluoromethyl)-1H-pyridine-2,6-diamine?
2-N,2-dimethyl-3-(trifluoromethyl)-1H-pyridine-2,6-diamine has a molecular weight of 207.20 g/mol, XLogP of 0.81, 1 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N,2-dimethyl-3-(trifluoromethyl)-1H-pyridine-2,6-diamine is sourced from PubChem (CID 154271649), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).