N-but-1-en-2-yl-5-(trifluoromethyl)piperidin-3-amine

C10H17F3N2 — CID 142586354

IUPACN-but-1-en-2-yl-5-(trifluoromethyl)piperidin-3-amine
SMILESC=C(CC)NC1CNCC(C(F)(F)F)C1
InChIInChI=1S/C10H17F3N2/c1-3-7(2)15-9-4-8(5-14-6-9)10(11,12)13/h8-9,14-15H,2-6H2,1H3
InChIKeyWUWQYCQGTCXUKA-UHFFFAOYSA-N
MW222.25 g/mol
LogP2.04
Rot. Bonds3

About N-but-1-en-2-yl-5-(trifluoromethyl)piperidin-3-amine

N-but-1-en-2-yl-5-(trifluoromethyl)piperidin-3-amine (PubChem CID 142586354) has the molecular formula C10H17F3N2 and a molecular weight of 222.25 g/mol. Its IUPAC name is N-but-1-en-2-yl-5-(trifluoromethyl)piperidin-3-amine.

Molecular Properties

Compound NameN-but-1-en-2-yl-5-(trifluoromethyl)piperidin-3-amine
PubChem CID142586354
Molecular FormulaC10H17F3N2
Molecular Weight222.25 g/mol
Exact Mass222.13
IUPAC NameN-but-1-en-2-yl-5-(trifluoromethyl)piperidin-3-amine
SMILESC=C(CC)NC1CNCC(C(F)(F)F)C1
InChIInChI=1S/C10H17F3N2/c1-3-7(2)15-9-4-8(5-14-6-9)10(11,12)13/h8-9,14-15H,2-6H2,1H3
InChIKeyWUWQYCQGTCXUKA-UHFFFAOYSA-N
XLogP2.04
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.25
LogP ≤ 52.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[2-(4,4-difluoropiperidin-1-yl)ethyl]-4,4-dimethylpent-1-en-2-amine
CID 129084034
(Z)-1-N-(5,5-difluoro-1-methylpiperidin-3-yl)prop-1-ene-1,2-diamine
CID 155330035
(Z)-1-N-(5,5-difluoropiperidin-3-yl)prop-1-ene-1,2-diamine
CID 155330089
N-(3,3-difluorobut-1-en-2-yl)-5-methylpiperidin-3-amine
CID 169691394
3-(3,3-difluoropiperidin-1-yl)-N-propan-2-ylprop-1-en-2-amine;2-methylhexane
CID 170569254
3-[4-(5-methylhexyl)-3-(trifluoromethyl)piperazin-1-yl]-N-propan-2-ylprop-1-en-2-amine
CID 170569295
3-[4-(2,2-difluoro-5-methylhexyl)-2,6-dimethylpiperazin-1-yl]-N-methylprop-1-en-2-amine;ethane
CID 170569354
1-But-1-en-2-yl-3-(difluoromethyl)piperazine
CID 172384286
1-(3-Methylbut-1-en-2-yl)-3-(trifluoromethyl)piperazine
CID 172384573
4-but-1-en-2-yl-N-[(Z)-1,1,1-trifluoropent-2-en-2-yl]piperidin-3-amine
CID 174047146
2,2,2-trifluoro-N-[1-[(2S)-1-methylpiperidin-2-yl]ethenyl]ethanamine
CID 158979568
3-[(2S)-2-[1-(ethylamino)ethenyl]-6-methylidenepiperidin-2-yl]-3,3-difluoro-N-methylpropan-1-amine
CID 166107623

Frequently Asked Questions

What is the IUPAC name of N-but-1-en-2-yl-5-(trifluoromethyl)piperidin-3-amine?
The IUPAC name of N-but-1-en-2-yl-5-(trifluoromethyl)piperidin-3-amine (CID 142586354) is N-but-1-en-2-yl-5-(trifluoromethyl)piperidin-3-amine.
What is the SMILES notation for N-but-1-en-2-yl-5-(trifluoromethyl)piperidin-3-amine?
The canonical SMILES for N-but-1-en-2-yl-5-(trifluoromethyl)piperidin-3-amine is C=C(CC)NC1CNCC(C(F)(F)F)C1.
What is the InChIKey of N-but-1-en-2-yl-5-(trifluoromethyl)piperidin-3-amine?
The InChIKey is WUWQYCQGTCXUKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17F3N2/c1-3-7(2)15-9-4-8(5-14-6-9)10(11,12)13/h8-9,14-15H,2-6H2,1H3.
What are the key properties of N-but-1-en-2-yl-5-(trifluoromethyl)piperidin-3-amine?
N-but-1-en-2-yl-5-(trifluoromethyl)piperidin-3-amine has a molecular weight of 222.25 g/mol, XLogP of 2.04, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-but-1-en-2-yl-5-(trifluoromethyl)piperidin-3-amine is sourced from PubChem (CID 142586354), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).