1-(4-phenylcyclohexyl)piperazine chloride

C16H24ClN2- — CID 53347254

IUPAC1-(4-phenylcyclohexyl)piperazine chloride
SMILES[Cl-].c1ccc(C2CCC(N3CCNCC3)CC2)cc1
InChIInChI=1S/C16H24N2.ClH/c1-2-4-14(5-3-1)15-6-8-16(9-7-15)18-12-10-17-11-13-18;/h1-5,15-17H,6-13H2;1H/p-1
InChIKeyPOOYWYOQFKXFTR-UHFFFAOYSA-M
MW279.83 g/mol
LogP-0.38
Rot. Bonds2

About 1-(4-phenylcyclohexyl)piperazine chloride

1-(4-phenylcyclohexyl)piperazine chloride (PubChem CID 53347254) has the molecular formula C16H24ClN2- and a molecular weight of 279.83 g/mol. Its IUPAC name is 1-(4-phenylcyclohexyl)piperazine chloride.

Molecular Properties

Compound Name1-(4-phenylcyclohexyl)piperazine chloride
PubChem CID53347254
Molecular FormulaC16H24ClN2-
Molecular Weight279.83 g/mol
Exact Mass279.16
IUPAC Name1-(4-phenylcyclohexyl)piperazine chloride
SMILES[Cl-].c1ccc(C2CCC(N3CCNCC3)CC2)cc1
InChIInChI=1S/C16H24N2.ClH/c1-2-4-14(5-3-1)15-6-8-16(9-7-15)18-12-10-17-11-13-18;/h1-5,15-17H,6-13H2;1H/p-1
InChIKeyPOOYWYOQFKXFTR-UHFFFAOYSA-M
XLogP-0.38
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.83
LogP ≤ 5-0.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(8R,9aS)-8-phenyl-2,3,4,6,7,8,9,9a-octahydro-1H-pyrido[1,2-a]pyrazine
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1-[4-(2-methylphenyl)cyclohexyl]piperazine
CID 82300745
(4-phenylcyclohexyl)-(3-piperazin-1-ylpyrrolidin-1-yl)methanone;hydrochloride
CID 120994311
2-[4-(4-phenylcyclohexyl)piperazin-1-yl]pyrimidine
CID 19958540
1-(1-phenylpiperidin-4-yl)piperazine
CID 2737157
1-phenyl-4-[1-(4-phenylcyclohexyl)piperidin-4-yl]piperazine
CID 1317152
benzene;cyclopropylbenzene
CID 144638417
1-cyclodecyl-4-phenylpiperidine;hydrochloride
CID 70215634
3-methyl-1-(4-phenylcyclohexyl)azetidine
CID 90791432
4-phenylpiperidine;sulfane;hydrochloride
CID 174499697
4-phenyl-1-(4-propan-2-ylcyclohexyl)piperidine
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(4-phenylcyclohexyl)-piperazin-1-ylmethanone
CID 119401928

Frequently Asked Questions

What is the IUPAC name of 1-(4-phenylcyclohexyl)piperazine chloride?
The IUPAC name of 1-(4-phenylcyclohexyl)piperazine chloride (CID 53347254) is 1-(4-phenylcyclohexyl)piperazine chloride.
What is the SMILES notation for 1-(4-phenylcyclohexyl)piperazine chloride?
The canonical SMILES for 1-(4-phenylcyclohexyl)piperazine chloride is [Cl-].c1ccc(C2CCC(N3CCNCC3)CC2)cc1.
What is the InChIKey of 1-(4-phenylcyclohexyl)piperazine chloride?
The InChIKey is POOYWYOQFKXFTR-UHFFFAOYSA-M. The full InChI is InChI=1S/C16H24N2.ClH/c1-2-4-14(5-3-1)15-6-8-16(9-7-15)18-12-10-17-11-13-18;/h1-5,15-17H,6-13H2;1H/p-1.
What are the key properties of 1-(4-phenylcyclohexyl)piperazine chloride?
1-(4-phenylcyclohexyl)piperazine chloride has a molecular weight of 279.83 g/mol, XLogP of -0.38, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-phenylcyclohexyl)piperazine chloride is sourced from PubChem (CID 53347254), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).