3-fluoro-1-[1-(1-propan-2-ylpiperidin-4-yl)ethenyl]piperidine

C15H27FN2 — CID 170195625

IUPAC3-fluoro-1-[1-(1-propan-2-ylpiperidin-4-yl)ethenyl]piperidine
SMILESC=C(C1CCN(C(C)C)CC1)N1CCCC(F)C1
InChIInChI=1S/C15H27FN2/c1-12(2)17-9-6-14(7-10-17)13(3)18-8-4-5-15(16)11-18/h12,14-15H,3-11H2,1-2H3
InChIKeyWIAAEQFOEZSADP-UHFFFAOYSA-N
MW254.39 g/mol
LogP3.05
Rot. Bonds3

About 3-fluoro-1-[1-(1-propan-2-ylpiperidin-4-yl)ethenyl]piperidine

3-fluoro-1-[1-(1-propan-2-ylpiperidin-4-yl)ethenyl]piperidine (PubChem CID 170195625) has the molecular formula C15H27FN2 and a molecular weight of 254.39 g/mol. Its IUPAC name is 3-fluoro-1-[1-(1-propan-2-ylpiperidin-4-yl)ethenyl]piperidine.

Molecular Properties

Compound Name3-fluoro-1-[1-(1-propan-2-ylpiperidin-4-yl)ethenyl]piperidine
PubChem CID170195625
Molecular FormulaC15H27FN2
Molecular Weight254.39 g/mol
Exact Mass254.22
IUPAC Name3-fluoro-1-[1-(1-propan-2-ylpiperidin-4-yl)ethenyl]piperidine
SMILESC=C(C1CCN(C(C)C)CC1)N1CCCC(F)C1
InChIInChI=1S/C15H27FN2/c1-12(2)17-9-6-14(7-10-17)13(3)18-8-4-5-15(16)11-18/h12,14-15H,3-11H2,1-2H3
InChIKeyWIAAEQFOEZSADP-UHFFFAOYSA-N
XLogP3.05
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.39
LogP ≤ 53.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-(fluoromethyl)-4-methyl-N-pent-1-en-2-ylpiperidin-1-amine
CID 155274560
3-Fluoro-2-methylidene-1-propan-2-ylpiperidine;2-methylidene-1-propan-2-yl-3-(trifluoromethyl)piperidine
CID 171846775
1-But-1-en-2-yl-3-fluoro-4-methylpiperidine
CID 177156790
1-[1-[1-(2-Fluoropropyl)piperidin-4-yl]ethenyl]piperazine
CID 178167042
1-(3-Fluoroprop-1-en-2-yl)-4-prop-1-en-2-ylpiperidine
CID 142835625
1-But-1-en-2-yl-4-(fluoromethyl)piperidine
CID 145230952
4-Ethyl-1-(3-ethylpent-1-en-2-yl)-4-fluoropiperidine
CID 165137260
1-Methyl-4-[3-(1-propan-2-ylpiperidin-4-yl)prop-1-en-2-yl]piperazine
CID 121277356
1-Methyl-4-(1-piperidin-1-ylethenyl)piperidine
CID 126735825
1-Tert-butyl-4-(1-piperidin-1-ylethenyl)piperidine
CID 129255741
2-Methylidene-1-(1-methylpiperidin-4-yl)piperidine
CID 142184382
Ethane;1-(3-fluoroprop-1-en-2-yl)-4-prop-1-en-2-ylpiperidine
CID 142835624

Frequently Asked Questions

What is the IUPAC name of 3-fluoro-1-[1-(1-propan-2-ylpiperidin-4-yl)ethenyl]piperidine?
The IUPAC name of 3-fluoro-1-[1-(1-propan-2-ylpiperidin-4-yl)ethenyl]piperidine (CID 170195625) is 3-fluoro-1-[1-(1-propan-2-ylpiperidin-4-yl)ethenyl]piperidine.
What is the SMILES notation for 3-fluoro-1-[1-(1-propan-2-ylpiperidin-4-yl)ethenyl]piperidine?
The canonical SMILES for 3-fluoro-1-[1-(1-propan-2-ylpiperidin-4-yl)ethenyl]piperidine is C=C(C1CCN(C(C)C)CC1)N1CCCC(F)C1.
What is the InChIKey of 3-fluoro-1-[1-(1-propan-2-ylpiperidin-4-yl)ethenyl]piperidine?
The InChIKey is WIAAEQFOEZSADP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27FN2/c1-12(2)17-9-6-14(7-10-17)13(3)18-8-4-5-15(16)11-18/h12,14-15H,3-11H2,1-2H3.
What are the key properties of 3-fluoro-1-[1-(1-propan-2-ylpiperidin-4-yl)ethenyl]piperidine?
3-fluoro-1-[1-(1-propan-2-ylpiperidin-4-yl)ethenyl]piperidine has a molecular weight of 254.39 g/mol, XLogP of 3.05, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoro-1-[1-(1-propan-2-ylpiperidin-4-yl)ethenyl]piperidine is sourced from PubChem (CID 170195625), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).