6-chloro-N-cyclopentyl-4-(trifluoromethyl)pyridin-2-amine

C11H12ClF3N2 — CID 102715432

IUPAC6-chloro-N-cyclopentyl-4-(trifluoromethyl)pyridin-2-amine
SMILESFC(F)(F)c1cc(Cl)nc(NC2CCCC2)c1
InChIInChI=1S/C11H12ClF3N2/c12-9-5-7(11(13,14)15)6-10(17-9)16-8-3-1-2-4-8/h5-6,8H,1-4H2,(H,16,17)
InChIKeyVBBBKMGPMRCZPG-UHFFFAOYSA-N
MW264.68 g/mol
LogP4.11
Rot. Bonds2

About 6-chloro-N-cyclopentyl-4-(trifluoromethyl)pyridin-2-amine

6-chloro-N-cyclopentyl-4-(trifluoromethyl)pyridin-2-amine (PubChem CID 102715432) has the molecular formula C11H12ClF3N2 and a molecular weight of 264.68 g/mol. Its IUPAC name is 6-chloro-N-cyclopentyl-4-(trifluoromethyl)pyridin-2-amine.

Molecular Properties

Compound Name6-chloro-N-cyclopentyl-4-(trifluoromethyl)pyridin-2-amine
PubChem CID102715432
Molecular FormulaC11H12ClF3N2
Molecular Weight264.68 g/mol
Exact Mass264.06
IUPAC Name6-chloro-N-cyclopentyl-4-(trifluoromethyl)pyridin-2-amine
SMILESFC(F)(F)c1cc(Cl)nc(NC2CCCC2)c1
InChIInChI=1S/C11H12ClF3N2/c12-9-5-7(11(13,14)15)6-10(17-9)16-8-3-1-2-4-8/h5-6,8H,1-4H2,(H,16,17)
InChIKeyVBBBKMGPMRCZPG-UHFFFAOYSA-N
XLogP4.11
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.68
LogP ≤ 54.11
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

6-chloro-N-(1-methylpiperidin-3-yl)-4-(trifluoromethyl)pyridin-2-amine
CID 102715566
6-chloro-N-(1-ethylpiperidin-4-yl)-4-(trifluoromethyl)pyridin-2-amine
CID 106193705
2-[[6-chloro-4-(trifluoromethyl)-2-pyridinyl]amino]cycloheptan-1-ol
CID 102716139
6-chloro-N-(2-methylcyclopropyl)-4-(trifluoromethyl)pyridin-2-amine
CID 102715826
6-chloro-N-(2,6-dimethylpiperidin-1-yl)-4-(trifluoromethyl)pyridin-2-amine
CID 102716115
2-chloro-6-(cyclobutylamino)pyridine-4-carbaldehyde
CID 115027180
methyl (2S)-3-[[6-chloro-4-(trifluoromethyl)-2-pyridinyl]amino]bicyclo[2.2.2]octane-2-carboxylate
CID 162602015
[2-[[[6-chloro-4-(trifluoromethyl)-2-pyridinyl]amino]methyl]cyclopentyl]methanol
CID 102716000
6-N-(1-methylpiperidin-4-yl)-4-(trifluoromethyl)pyridine-2,6-diamine
CID 102717481
6-chloro-N-(2,6-dichlorophenyl)-4-(trifluoromethyl)pyridin-2-amine
CID 102715985
6-chloro-N-cyclopentyl-2-(methoxymethyl)pyrimidin-4-amine
CID 82463145
6-chloro-N-(1-ethylpiperidin-4-yl)-2-(trifluoromethyl)pyrimidin-4-amine
CID 106193711

Frequently Asked Questions

What is the IUPAC name of 6-chloro-N-cyclopentyl-4-(trifluoromethyl)pyridin-2-amine?
The IUPAC name of 6-chloro-N-cyclopentyl-4-(trifluoromethyl)pyridin-2-amine (CID 102715432) is 6-chloro-N-cyclopentyl-4-(trifluoromethyl)pyridin-2-amine.
What is the SMILES notation for 6-chloro-N-cyclopentyl-4-(trifluoromethyl)pyridin-2-amine?
The canonical SMILES for 6-chloro-N-cyclopentyl-4-(trifluoromethyl)pyridin-2-amine is FC(F)(F)c1cc(Cl)nc(NC2CCCC2)c1.
What is the InChIKey of 6-chloro-N-cyclopentyl-4-(trifluoromethyl)pyridin-2-amine?
The InChIKey is VBBBKMGPMRCZPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12ClF3N2/c12-9-5-7(11(13,14)15)6-10(17-9)16-8-3-1-2-4-8/h5-6,8H,1-4H2,(H,16,17).
What are the key properties of 6-chloro-N-cyclopentyl-4-(trifluoromethyl)pyridin-2-amine?
6-chloro-N-cyclopentyl-4-(trifluoromethyl)pyridin-2-amine has a molecular weight of 264.68 g/mol, XLogP of 4.11, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-N-cyclopentyl-4-(trifluoromethyl)pyridin-2-amine is sourced from PubChem (CID 102715432), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).