3-[6-(trifluoromethyl)-2-pyridinyl]cyclobutan-1-amine

C10H11F3N2 — CID 178166227

IUPAC3-[6-(trifluoromethyl)-2-pyridinyl]cyclobutan-1-amine
SMILESNC1CC(c2cccc(C(F)(F)F)n2)C1
InChIInChI=1S/C10H11F3N2/c11-10(12,13)9-3-1-2-8(15-9)6-4-7(14)5-6/h1-3,6-7H,4-5,14H2
InChIKeyBNRGQUCUCSBARH-UHFFFAOYSA-N
MW216.21 g/mol
LogP2.31
Rot. Bonds1

About 3-[6-(trifluoromethyl)-2-pyridinyl]cyclobutan-1-amine

3-[6-(trifluoromethyl)-2-pyridinyl]cyclobutan-1-amine (PubChem CID 178166227) has the molecular formula C10H11F3N2 and a molecular weight of 216.21 g/mol. Its IUPAC name is 3-[6-(trifluoromethyl)-2-pyridinyl]cyclobutan-1-amine.

Molecular Properties

Compound Name3-[6-(trifluoromethyl)-2-pyridinyl]cyclobutan-1-amine
PubChem CID178166227
Molecular FormulaC10H11F3N2
Molecular Weight216.21 g/mol
Exact Mass216.09
IUPAC Name3-[6-(trifluoromethyl)-2-pyridinyl]cyclobutan-1-amine
SMILESNC1CC(c2cccc(C(F)(F)F)n2)C1
InChIInChI=1S/C10H11F3N2/c11-10(12,13)9-3-1-2-8(15-9)6-4-7(14)5-6/h1-3,6-7H,4-5,14H2
InChIKeyBNRGQUCUCSBARH-UHFFFAOYSA-N
XLogP2.31
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.21
LogP ≤ 52.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(6-cyclopropyl-2-pyridinyl)propan-2-amine
CID 58129507
2-[6-(trifluoromethyl)-2-pyridinyl]-7-azaspiro[3.5]nonane-7-carboxylic acid
CID 151423212
6-[6-(trifluoromethyl)-2-pyridinyl]-2-azaspiro[3.4]octane-2-carbaldehyde
CID 169002396
N-[(3-aminocyclohexyl)methyl]-6-(trifluoromethyl)pyridin-2-amine
CID 106128015
2-pyridin-2-yl-6-(trifluoromethyl)pyridine
CID 72771068
3-[5-chloro-6-(trifluoromethyl)-2-pyridinyl]cyclohexan-1-amine
CID 153367440
2,2-dimethyl-N-[2-[4-[6-(trifluoromethyl)-2-pyridinyl]piperidin-1-yl]ethyl]propan-1-amine
CID 151092475
[6-(trifluoromethyl)-2-pyridinyl]methanediamine
CID 135243406
ethane;2-methyl-6-(trifluoromethyl)pyridine
CID 144746626
3-[[6-(trifluoromethyl)-3-pyridinyl]oxy]cyclobutan-1-amine
CID 146203808
3-[6-(trifluoromethyl)-2-pyridinyl]bicyclo[1.1.1]pentan-1-amine
CID 142474662
(1R,3R,5S)-3-methyl-5-pyridin-2-ylcyclohexan-1-amine
CID 142796329

Frequently Asked Questions

What is the IUPAC name of 3-[6-(trifluoromethyl)-2-pyridinyl]cyclobutan-1-amine?
The IUPAC name of 3-[6-(trifluoromethyl)-2-pyridinyl]cyclobutan-1-amine (CID 178166227) is 3-[6-(trifluoromethyl)-2-pyridinyl]cyclobutan-1-amine.
What is the SMILES notation for 3-[6-(trifluoromethyl)-2-pyridinyl]cyclobutan-1-amine?
The canonical SMILES for 3-[6-(trifluoromethyl)-2-pyridinyl]cyclobutan-1-amine is NC1CC(c2cccc(C(F)(F)F)n2)C1.
What is the InChIKey of 3-[6-(trifluoromethyl)-2-pyridinyl]cyclobutan-1-amine?
The InChIKey is BNRGQUCUCSBARH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11F3N2/c11-10(12,13)9-3-1-2-8(15-9)6-4-7(14)5-6/h1-3,6-7H,4-5,14H2.
What are the key properties of 3-[6-(trifluoromethyl)-2-pyridinyl]cyclobutan-1-amine?
3-[6-(trifluoromethyl)-2-pyridinyl]cyclobutan-1-amine has a molecular weight of 216.21 g/mol, XLogP of 2.31, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[6-(trifluoromethyl)-2-pyridinyl]cyclobutan-1-amine is sourced from PubChem (CID 178166227), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).