1-(1-cyclohexyl-1-phenylpropan-2-yl)piperazine

C19H30N2 — CID 3030108

IUPAC1-(1-cyclohexyl-1-phenylpropan-2-yl)piperazine
SMILESCC(C(c1ccccc1)C1CCCCC1)N1CCNCC1
InChIInChI=1S/C19H30N2/c1-16(21-14-12-20-13-15-21)19(17-8-4-2-5-9-17)18-10-6-3-7-11-18/h2,4-5,8-9,16,18-20H,3,6-7,10-15H2,1H3
InChIKeyWFNUGJKIEVBPBJ-UHFFFAOYSA-N
MW286.46 g/mol
LogP3.64
Rot. Bonds4

About 1-(1-cyclohexyl-1-phenylpropan-2-yl)piperazine

1-(1-cyclohexyl-1-phenylpropan-2-yl)piperazine (PubChem CID 3030108) has the molecular formula C19H30N2 and a molecular weight of 286.46 g/mol. Its IUPAC name is 1-(1-cyclohexyl-1-phenylpropan-2-yl)piperazine.

Molecular Properties

Compound Name1-(1-cyclohexyl-1-phenylpropan-2-yl)piperazine
PubChem CID3030108
Molecular FormulaC19H30N2
Molecular Weight286.46 g/mol
Exact Mass286.24
IUPAC Name1-(1-cyclohexyl-1-phenylpropan-2-yl)piperazine
SMILESCC(C(c1ccccc1)C1CCCCC1)N1CCNCC1
InChIInChI=1S/C19H30N2/c1-16(21-14-12-20-13-15-21)19(17-8-4-2-5-9-17)18-10-6-3-7-11-18/h2,4-5,8-9,16,18-20H,3,6-7,10-15H2,1H3
InChIKeyWFNUGJKIEVBPBJ-UHFFFAOYSA-N
XLogP3.64
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.46
LogP ≤ 53.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-phenyl-2-piperazin-1-ylpropan-1-ol
CID 82264476
1-[cyclobutyl(phenyl)methyl]piperazine
CID 82288990
1-[(1S)-1-phenylethyl]piperazine;dihydrochloride
CID 57383523
1-[(R)-cyclohexyl-(3-methoxyphenyl)methyl]piperazine;dihydrochloride
CID 171286720
1-[(R)-(2-tert-butylsulfanylphenyl)-cyclohexylmethyl]piperazine
CID 171295895
1-[(R)-cyclohexyl(naphthalen-2-yl)methyl]piperazine
CID 171287522
1-[(R)-cyclohexyl-(3-iodophenyl)methyl]piperazine
CID 171293328
1-[(S)-cyclopentyl-(2-methylphenyl)methyl]piperazine
CID 171280314
1-[(S)-cyclohexyl-(2,6-dimethylphenyl)methyl]piperazine
CID 171277119
1-[(S)-cyclohexyl-(3-fluorophenyl)methyl]piperazine;hydrochloride
CID 171163455
1-[(R)-cyclopentyl-(4-methoxyphenyl)methyl]piperazine
CID 95477353
1-[bromo(phenyl)methyl]piperazine
CID 174618409

Frequently Asked Questions

What is the IUPAC name of 1-(1-cyclohexyl-1-phenylpropan-2-yl)piperazine?
The IUPAC name of 1-(1-cyclohexyl-1-phenylpropan-2-yl)piperazine (CID 3030108) is 1-(1-cyclohexyl-1-phenylpropan-2-yl)piperazine.
What is the SMILES notation for 1-(1-cyclohexyl-1-phenylpropan-2-yl)piperazine?
The canonical SMILES for 1-(1-cyclohexyl-1-phenylpropan-2-yl)piperazine is CC(C(c1ccccc1)C1CCCCC1)N1CCNCC1.
What is the InChIKey of 1-(1-cyclohexyl-1-phenylpropan-2-yl)piperazine?
The InChIKey is WFNUGJKIEVBPBJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H30N2/c1-16(21-14-12-20-13-15-21)19(17-8-4-2-5-9-17)18-10-6-3-7-11-18/h2,4-5,8-9,16,18-20H,3,6-7,10-15H2,1H3.
What are the key properties of 1-(1-cyclohexyl-1-phenylpropan-2-yl)piperazine?
1-(1-cyclohexyl-1-phenylpropan-2-yl)piperazine has a molecular weight of 286.46 g/mol, XLogP of 3.64, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-cyclohexyl-1-phenylpropan-2-yl)piperazine is sourced from PubChem (CID 3030108), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).