2-fluoro-1-[1-(1-propan-2-ylpiperidin-4-yl)piperidin-4-yl]ethanone

C15H27FN2O — CID 170144751

IUPAC2-fluoro-1-[1-(1-propan-2-ylpiperidin-4-yl)piperidin-4-yl]ethanone
SMILESCC(C)N1CCC(N2CCC(C(=O)CF)CC2)CC1
InChIInChI=1S/C15H27FN2O/c1-12(2)17-9-5-14(6-10-17)18-7-3-13(4-8-18)15(19)11-16/h12-14H,3-11H2,1-2H3
InChIKeyDPPNFHWNPMRAAU-UHFFFAOYSA-N
MW270.39 g/mol
LogP2.11
Rot. Bonds4

About 2-fluoro-1-[1-(1-propan-2-ylpiperidin-4-yl)piperidin-4-yl]ethanone

2-fluoro-1-[1-(1-propan-2-ylpiperidin-4-yl)piperidin-4-yl]ethanone (PubChem CID 170144751) has the molecular formula C15H27FN2O and a molecular weight of 270.39 g/mol. Its IUPAC name is 2-fluoro-1-[1-(1-propan-2-ylpiperidin-4-yl)piperidin-4-yl]ethanone.

Molecular Properties

Compound Name2-fluoro-1-[1-(1-propan-2-ylpiperidin-4-yl)piperidin-4-yl]ethanone
PubChem CID170144751
Molecular FormulaC15H27FN2O
Molecular Weight270.39 g/mol
Exact Mass270.21
IUPAC Name2-fluoro-1-[1-(1-propan-2-ylpiperidin-4-yl)piperidin-4-yl]ethanone
SMILESCC(C)N1CCC(N2CCC(C(=O)CF)CC2)CC1
InChIInChI=1S/C15H27FN2O/c1-12(2)17-9-5-14(6-10-17)18-7-3-13(4-8-18)15(19)11-16/h12-14H,3-11H2,1-2H3
InChIKeyDPPNFHWNPMRAAU-UHFFFAOYSA-N
XLogP2.11
TPSA23.55 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.39
LogP ≤ 52.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-propan-2-yl-1-(1-propan-2-ylpiperidin-4-yl)piperidine-4-carboxamide
CID 28955653
ethane;1-(1-propan-2-ylpiperidin-4-yl)ethanone
CID 177135939
4-(azetidin-1-yl)-1-propan-2-ylpiperidine
CID 21054794
ethane;(1-methylpiperidin-4-yl)-[4-(1-propan-2-ylpiperidin-4-yl)piperazin-1-yl]methanone
CID 176568951
2-(4-pyrrolidin-1-ylpiperidin-1-yl)propanoic acid
CID 121201886
1-[4-(4-propan-2-ylpiperazin-1-yl)piperidin-1-yl]ethanone
CID 156836562
cyclopropyl-[4-(4-propan-2-ylpiperazin-1-yl)piperidin-1-yl]methanone
CID 130296017
(1-propan-2-ylpiperidin-4-yl)-[4-(1-propan-2-ylpyrrolidin-3-yl)piperazin-1-yl]methanone
CID 177124210
2-methyl-N-propan-2-yl-N-[1-(1-propan-2-ylpiperidin-4-yl)piperidin-4-yl]propanamide
CID 170184790
4-[(3R)-3-fluoropyrrolidin-1-yl]-1-propan-2-ylpiperidine
CID 156546117
[1-(4-propan-2-ylcyclohexyl)piperidin-4-yl]-(4-propan-2-ylpiperazin-1-yl)methanone
CID 176796856
4-methoxy-1-(1-propan-2-ylpiperidin-4-yl)piperidine
CID 146498238

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-1-[1-(1-propan-2-ylpiperidin-4-yl)piperidin-4-yl]ethanone?
The IUPAC name of 2-fluoro-1-[1-(1-propan-2-ylpiperidin-4-yl)piperidin-4-yl]ethanone (CID 170144751) is 2-fluoro-1-[1-(1-propan-2-ylpiperidin-4-yl)piperidin-4-yl]ethanone.
What is the SMILES notation for 2-fluoro-1-[1-(1-propan-2-ylpiperidin-4-yl)piperidin-4-yl]ethanone?
The canonical SMILES for 2-fluoro-1-[1-(1-propan-2-ylpiperidin-4-yl)piperidin-4-yl]ethanone is CC(C)N1CCC(N2CCC(C(=O)CF)CC2)CC1.
What is the InChIKey of 2-fluoro-1-[1-(1-propan-2-ylpiperidin-4-yl)piperidin-4-yl]ethanone?
The InChIKey is DPPNFHWNPMRAAU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27FN2O/c1-12(2)17-9-5-14(6-10-17)18-7-3-13(4-8-18)15(19)11-16/h12-14H,3-11H2,1-2H3.
What are the key properties of 2-fluoro-1-[1-(1-propan-2-ylpiperidin-4-yl)piperidin-4-yl]ethanone?
2-fluoro-1-[1-(1-propan-2-ylpiperidin-4-yl)piperidin-4-yl]ethanone has a molecular weight of 270.39 g/mol, XLogP of 2.11, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-1-[1-(1-propan-2-ylpiperidin-4-yl)piperidin-4-yl]ethanone is sourced from PubChem (CID 170144751), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).