3-(3,3,3-trifluoropropyl)pyridin-2-amine

C8H9F3N2 — CID 163672199

IUPAC3-(3,3,3-trifluoropropyl)pyridin-2-amine
SMILESNc1ncccc1CCC(F)(F)F
InChIInChI=1S/C8H9F3N2/c9-8(10,11)4-3-6-2-1-5-13-7(6)12/h1-2,5H,3-4H2,(H2,12,13)
InChIKeyJDNNBVMDAATFLX-UHFFFAOYSA-N
MW190.17 g/mol
LogP2.16
Rot. Bonds2

About 3-(3,3,3-trifluoropropyl)pyridin-2-amine

3-(3,3,3-trifluoropropyl)pyridin-2-amine (PubChem CID 163672199) has the molecular formula C8H9F3N2 and a molecular weight of 190.17 g/mol. Its IUPAC name is 3-(3,3,3-trifluoropropyl)pyridin-2-amine.

Molecular Properties

Compound Name3-(3,3,3-trifluoropropyl)pyridin-2-amine
PubChem CID163672199
Molecular FormulaC8H9F3N2
Molecular Weight190.17 g/mol
Exact Mass190.07
IUPAC Name3-(3,3,3-trifluoropropyl)pyridin-2-amine
SMILESNc1ncccc1CCC(F)(F)F
InChIInChI=1S/C8H9F3N2/c9-8(10,11)4-3-6-2-1-5-13-7(6)12/h1-2,5H,3-4H2,(H2,12,13)
InChIKeyJDNNBVMDAATFLX-UHFFFAOYSA-N
XLogP2.16
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.17
LogP ≤ 52.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-(4,4,4-trifluorobutoxymethyl)pyridin-2-amine
CID 82792853
ethane;3-propylpyridin-2-amine
CID 176926436
3-[2-(2,6-difluorophenyl)ethyl]pyridin-2-amine
CID 114934293
2-propan-2-ylsulfanyl-3-(3,3,3-trifluoropropyl)pyridine
CID 165364825
1-(2-amino-3-pyridinyl)-4,4-dimethylpentan-3-one
CID 64503842
3-N-(4,4,4-trifluorobutyl)pyridine-2,3-diamine
CID 104540631
3-[2-(3,4-difluorophenyl)ethyl]pyridin-2-amine
CID 82924582
3-(aminomethyl)pyridin-2-amine;2,2-dimethylpropane;ethane
CID 162183420
3-(2-ethylsulfonylethyl)pyridin-2-amine
CID 106731715
3-(3-aminopentyl)pyridin-2-amine
CID 64505573
3-[4,4,4-trifluoro-1-(methylamino)butyl]pyridin-2-amine
CID 79954451
3-[2-(2-methylpropoxy)ethyl]pyridin-2-amine
CID 106458112

Frequently Asked Questions

What is the IUPAC name of 3-(3,3,3-trifluoropropyl)pyridin-2-amine?
The IUPAC name of 3-(3,3,3-trifluoropropyl)pyridin-2-amine (CID 163672199) is 3-(3,3,3-trifluoropropyl)pyridin-2-amine.
What is the SMILES notation for 3-(3,3,3-trifluoropropyl)pyridin-2-amine?
The canonical SMILES for 3-(3,3,3-trifluoropropyl)pyridin-2-amine is Nc1ncccc1CCC(F)(F)F.
What is the InChIKey of 3-(3,3,3-trifluoropropyl)pyridin-2-amine?
The InChIKey is JDNNBVMDAATFLX-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9F3N2/c9-8(10,11)4-3-6-2-1-5-13-7(6)12/h1-2,5H,3-4H2,(H2,12,13).
What are the key properties of 3-(3,3,3-trifluoropropyl)pyridin-2-amine?
3-(3,3,3-trifluoropropyl)pyridin-2-amine has a molecular weight of 190.17 g/mol, XLogP of 2.16, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3,3,3-trifluoropropyl)pyridin-2-amine is sourced from PubChem (CID 163672199), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).