trans-(1R,2R)-2-(4-phenylpiperazin-1-yl)cyclohexan-1-ol

C16H24N2O — CID 15925789

IUPACtrans-(1R,2R)-2-(4-phenylpiperazin-1-yl)cyclohexan-1-ol
SMILESO[C@@H]1CCCC[C@H]1N1CCN(c2ccccc2)CC1
InChIInChI=1S/C16H24N2O/c19-16-9-5-4-8-15(16)18-12-10-17(11-13-18)14-6-2-1-3-7-14/h1-3,6-7,15-16,19H,4-5,8-13H2/t15-,16-/m1/s1
InChIKeyBAAMFQVLPJYVQQ-HZPDHXFCSA-N
MW260.38 g/mol
LogP2.11
Rot. Bonds2

About trans-(1R,2R)-2-(4-phenylpiperazin-1-yl)cyclohexan-1-ol

trans-(1R,2R)-2-(4-phenylpiperazin-1-yl)cyclohexan-1-ol (PubChem CID 15925789) has the molecular formula C16H24N2O and a molecular weight of 260.38 g/mol. Its IUPAC name is trans-(1R,2R)-2-(4-phenylpiperazin-1-yl)cyclohexan-1-ol.

Molecular Properties

Compound Nametrans-(1R,2R)-2-(4-phenylpiperazin-1-yl)cyclohexan-1-ol
PubChem CID15925789
Molecular FormulaC16H24N2O
Molecular Weight260.38 g/mol
Exact Mass260.19
IUPAC Nametrans-(1R,2R)-2-(4-phenylpiperazin-1-yl)cyclohexan-1-ol
SMILESO[C@@H]1CCCC[C@H]1N1CCN(c2ccccc2)CC1
InChIInChI=1S/C16H24N2O/c19-16-9-5-4-8-15(16)18-12-10-17(11-13-18)14-6-2-1-3-7-14/h1-3,6-7,15-16,19H,4-5,8-13H2/t15-,16-/m1/s1
InChIKeyBAAMFQVLPJYVQQ-HZPDHXFCSA-N
XLogP2.11
TPSA26.71 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.38
LogP ≤ 52.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

Dropropizine
CID 3169
Levodropropizine
CID 65859
1-Piperazineethanol, 4-phenyl-
CID 96699
1-(Cyclohexyloxy)-3-(4-phenyl-1-piperazinyl)-2-propanol
CID 2933098
(2R)-3-(4-Phenylpiperazin-1-yl)propane-1,2-diol
CID 688451
1-Propanaminium, 3-(diphenylamino)-2-hydroxy-N,N-dimethyl-N-(1-methylethyl)-, iodide, (+-)-
CID 3064865
Cambridge id 5236883
CID 2836178
2-(4-Phenyl-piperazin-1-yl)-cyclohexanol
CID 15925788
2-(4-o-Tolyl-piperazin-1-yl)-cyclohexanol
CID 15925813
2-[4-(4-Dimethylamino-phenyl)-piperidin-1-yl]-cyclohexanol
CID 15925824
2-(3-Methyl-4-phenyl-piperazin-1-yl)-cyclohexanol
CID 15925877
2-[4-(2,5-Dimethyl-phenyl)-piperazin-1-yl]-cyclohexanol
CID 15925887

Frequently Asked Questions

What is the IUPAC name of trans-(1R,2R)-2-(4-phenylpiperazin-1-yl)cyclohexan-1-ol?
The IUPAC name of trans-(1R,2R)-2-(4-phenylpiperazin-1-yl)cyclohexan-1-ol (CID 15925789) is trans-(1R,2R)-2-(4-phenylpiperazin-1-yl)cyclohexan-1-ol.
What is the SMILES notation for trans-(1R,2R)-2-(4-phenylpiperazin-1-yl)cyclohexan-1-ol?
The canonical SMILES for trans-(1R,2R)-2-(4-phenylpiperazin-1-yl)cyclohexan-1-ol is O[C@@H]1CCCC[C@H]1N1CCN(c2ccccc2)CC1.
What is the InChIKey of trans-(1R,2R)-2-(4-phenylpiperazin-1-yl)cyclohexan-1-ol?
The InChIKey is BAAMFQVLPJYVQQ-HZPDHXFCSA-N. The full InChI is InChI=1S/C16H24N2O/c19-16-9-5-4-8-15(16)18-12-10-17(11-13-18)14-6-2-1-3-7-14/h1-3,6-7,15-16,19H,4-5,8-13H2/t15-,16-/m1/s1.
What are the key properties of trans-(1R,2R)-2-(4-phenylpiperazin-1-yl)cyclohexan-1-ol?
trans-(1R,2R)-2-(4-phenylpiperazin-1-yl)cyclohexan-1-ol has a molecular weight of 260.38 g/mol, XLogP of 2.11, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for trans-(1R,2R)-2-(4-phenylpiperazin-1-yl)cyclohexan-1-ol is sourced from PubChem (CID 15925789), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).