1-(4,4-difluorocyclohexyl)piperazine

C10H18F2N2 — CID 130949503

IUPAC1-(4,4-difluorocyclohexyl)piperazine
SMILESFC1(F)CCC(N2CCNCC2)CC1
InChIInChI=1S/C10H18F2N2/c11-10(12)3-1-9(2-4-10)14-7-5-13-6-8-14/h9,13H,1-8H2
InChIKeyOBDKCMYSVYCHDP-UHFFFAOYSA-N
MW204.26 g/mol
LogP1.47
Rot. Bonds1

About 1-(4,4-difluorocyclohexyl)piperazine

1-(4,4-difluorocyclohexyl)piperazine (PubChem CID 130949503) has the molecular formula C10H18F2N2 and a molecular weight of 204.26 g/mol. Its IUPAC name is 1-(4,4-difluorocyclohexyl)piperazine.

Molecular Properties

Compound Name1-(4,4-difluorocyclohexyl)piperazine
PubChem CID130949503
Molecular FormulaC10H18F2N2
Molecular Weight204.26 g/mol
Exact Mass204.14
IUPAC Name1-(4,4-difluorocyclohexyl)piperazine
SMILESFC1(F)CCC(N2CCNCC2)CC1
InChIInChI=1S/C10H18F2N2/c11-10(12)3-1-9(2-4-10)14-7-5-13-6-8-14/h9,13H,1-8H2
InChIKeyOBDKCMYSVYCHDP-UHFFFAOYSA-N
XLogP1.47
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.26
LogP ≤ 51.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-Cyclohexylpiperazine
CID 87298
(1R,2R)-2-(Piperidin-1-yl)cyclohexanamine
CID 12156300
6-(Trifluoromethyl)piperidin-3-amine
CID 42628739
5,5-Difluoropiperidin-3-amine
CID 91012064
(3S)-1-(cyclohexylmethyl)-N-(4,4,4-trifluorobutyl)piperidin-3-amine
CID 51633656
(S)-1-((4,4-Difluoropyrrolidin-2-yl)methyl)piperidine
CID 124052743
2-[(3S)-3-(2,2,2-trifluoroethylamino)piperidin-1-yl]acetonitrile
CID 164642254
N-[2-(4,4-difluoropiperidin-1-yl)ethyl]propan-2-amine
CID 23518732
N-[2-(4-fluoropiperidin-1-yl)ethyl]propan-2-amine
CID 23518733
1-(2,2,2-Trifluoroethyl)piperidin-3-amine
CID 24711865
R 1-(2,2,2-Trifluoro-ethyl)-piperidin-3-ylamine
CID 28365482
[1-(2,2,2-Trifluoroethyl)piperidin-2-yl]methanamine
CID 43187045

Frequently Asked Questions

What is the IUPAC name of 1-(4,4-difluorocyclohexyl)piperazine?
The IUPAC name of 1-(4,4-difluorocyclohexyl)piperazine (CID 130949503) is 1-(4,4-difluorocyclohexyl)piperazine.
What is the SMILES notation for 1-(4,4-difluorocyclohexyl)piperazine?
The canonical SMILES for 1-(4,4-difluorocyclohexyl)piperazine is FC1(F)CCC(N2CCNCC2)CC1.
What is the InChIKey of 1-(4,4-difluorocyclohexyl)piperazine?
The InChIKey is OBDKCMYSVYCHDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18F2N2/c11-10(12)3-1-9(2-4-10)14-7-5-13-6-8-14/h9,13H,1-8H2.
What are the key properties of 1-(4,4-difluorocyclohexyl)piperazine?
1-(4,4-difluorocyclohexyl)piperazine has a molecular weight of 204.26 g/mol, XLogP of 1.47, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4,4-difluorocyclohexyl)piperazine is sourced from PubChem (CID 130949503), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).