6-N-(2-methylcycloheptyl)-4-(trifluoromethyl)pyridine-2,6-diamine

C14H20F3N3 — CID 102718779

IUPAC6-N-(2-methylcycloheptyl)-4-(trifluoromethyl)pyridine-2,6-diamine
SMILESCC1CCCCCC1Nc1cc(C(F)(F)F)cc(N)n1
InChIInChI=1S/C14H20F3N3/c1-9-5-3-2-4-6-11(9)19-13-8-10(14(15,16)17)7-12(18)20-13/h7-9,11H,2-6H2,1H3,(H3,18,19,20)
InChIKeyHIGYWCIDSQALKJ-UHFFFAOYSA-N
MW287.33 g/mol
LogP4.06
Rot. Bonds2

About 6-N-(2-methylcycloheptyl)-4-(trifluoromethyl)pyridine-2,6-diamine

6-N-(2-methylcycloheptyl)-4-(trifluoromethyl)pyridine-2,6-diamine (PubChem CID 102718779) has the molecular formula C14H20F3N3 and a molecular weight of 287.33 g/mol. Its IUPAC name is 6-N-(2-methylcycloheptyl)-4-(trifluoromethyl)pyridine-2,6-diamine.

Molecular Properties

Compound Name6-N-(2-methylcycloheptyl)-4-(trifluoromethyl)pyridine-2,6-diamine
PubChem CID102718779
Molecular FormulaC14H20F3N3
Molecular Weight287.33 g/mol
Exact Mass287.16
IUPAC Name6-N-(2-methylcycloheptyl)-4-(trifluoromethyl)pyridine-2,6-diamine
SMILESCC1CCCCCC1Nc1cc(C(F)(F)F)cc(N)n1
InChIInChI=1S/C14H20F3N3/c1-9-5-3-2-4-6-11(9)19-13-8-10(14(15,16)17)7-12(18)20-13/h7-9,11H,2-6H2,1H3,(H3,18,19,20)
InChIKeyHIGYWCIDSQALKJ-UHFFFAOYSA-N
XLogP4.06
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.33
LogP ≤ 54.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 6-N-(2-methylcycloheptyl)-4-(trifluoromethyl)pyridine-2,6-diamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-N-ethyl-6-N-(2-methylcyclohexyl)-4-(trifluoromethyl)pyridine-2,6-diamine
CID 102717341
6-hydrazinyl-4-N-(2-methylcycloheptyl)pyrimidine-2,4-diamine
CID 80925560
6-hydrazinyl-N-(2-methylcyclopentyl)-2-(trifluoromethyl)pyrimidin-4-amine
CID 106775688
6-N-(1-methylpiperidin-4-yl)-4-(trifluoromethyl)pyridine-2,6-diamine
CID 102717481
N-(2-ethylcyclohexyl)-6-hydrazinyl-4-(trifluoromethyl)pyridin-2-amine
CID 102720558
2-[[6-(ethylamino)-4-(trifluoromethyl)-2-pyridinyl]amino]cyclohexan-1-ol
CID 102718306
2-[[6-chloro-4-(trifluoromethyl)-2-pyridinyl]amino]cycloheptan-1-ol
CID 102716139
6-N-propan-2-yl-4-(trifluoromethyl)pyridine-2,6-diamine
CID 102717244
6-N-(1-ethylpiperidin-3-yl)-4-(trifluoromethyl)pyridine-2,6-diamine
CID 102717902
6-N-methyl-6-N-(2-methylcyclohexyl)-4-(trifluoromethyl)pyridine-2,6-diamine
CID 102718072
6-N-(2,2-dimethyloxan-4-yl)-4-(trifluoromethyl)pyridine-2,6-diamine
CID 102719095
6-chloro-N-(2-methylcyclopropyl)-4-(trifluoromethyl)pyridin-2-amine
CID 102715826

Frequently Asked Questions

What is the IUPAC name of 6-N-(2-methylcycloheptyl)-4-(trifluoromethyl)pyridine-2,6-diamine?
The IUPAC name of 6-N-(2-methylcycloheptyl)-4-(trifluoromethyl)pyridine-2,6-diamine (CID 102718779) is 6-N-(2-methylcycloheptyl)-4-(trifluoromethyl)pyridine-2,6-diamine.
What is the SMILES notation for 6-N-(2-methylcycloheptyl)-4-(trifluoromethyl)pyridine-2,6-diamine?
The canonical SMILES for 6-N-(2-methylcycloheptyl)-4-(trifluoromethyl)pyridine-2,6-diamine is CC1CCCCCC1Nc1cc(C(F)(F)F)cc(N)n1.
What is the InChIKey of 6-N-(2-methylcycloheptyl)-4-(trifluoromethyl)pyridine-2,6-diamine?
The InChIKey is HIGYWCIDSQALKJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20F3N3/c1-9-5-3-2-4-6-11(9)19-13-8-10(14(15,16)17)7-12(18)20-13/h7-9,11H,2-6H2,1H3,(H3,18,19,20).
What are the key properties of 6-N-(2-methylcycloheptyl)-4-(trifluoromethyl)pyridine-2,6-diamine?
6-N-(2-methylcycloheptyl)-4-(trifluoromethyl)pyridine-2,6-diamine has a molecular weight of 287.33 g/mol, XLogP of 4.06, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-N-(2-methylcycloheptyl)-4-(trifluoromethyl)pyridine-2,6-diamine is sourced from PubChem (CID 102718779), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).