1-[[4-(2-hydroxy-2-methylpropyl)piperazin-1-yl]methyl]cyclohexan-1-ol

C15H30N2O2 — CID 63632763

IUPAC1-[[4-(2-hydroxy-2-methylpropyl)piperazin-1-yl]methyl]cyclohexan-1-ol
SMILESCC(C)(O)CN1CCN(CC2(O)CCCCC2)CC1
InChIInChI=1S/C15H30N2O2/c1-14(2,18)12-16-8-10-17(11-9-16)13-15(19)6-4-3-5-7-15/h18-19H,3-13H2,1-2H3
InChIKeyADNHVXJWISDOCK-UHFFFAOYSA-N
MW270.42 g/mol
LogP1.07
Rot. Bonds4

About 1-[[4-(2-hydroxy-2-methylpropyl)piperazin-1-yl]methyl]cyclohexan-1-ol

1-[[4-(2-hydroxy-2-methylpropyl)piperazin-1-yl]methyl]cyclohexan-1-ol (PubChem CID 63632763) has the molecular formula C15H30N2O2 and a molecular weight of 270.42 g/mol. Its IUPAC name is 1-[[4-(2-hydroxy-2-methylpropyl)piperazin-1-yl]methyl]cyclohexan-1-ol.

Molecular Properties

Compound Name1-[[4-(2-hydroxy-2-methylpropyl)piperazin-1-yl]methyl]cyclohexan-1-ol
PubChem CID63632763
Molecular FormulaC15H30N2O2
Molecular Weight270.42 g/mol
Exact Mass270.23
IUPAC Name1-[[4-(2-hydroxy-2-methylpropyl)piperazin-1-yl]methyl]cyclohexan-1-ol
SMILESCC(C)(O)CN1CCN(CC2(O)CCCCC2)CC1
InChIInChI=1S/C15H30N2O2/c1-14(2,18)12-16-8-10-17(11-9-16)13-15(19)6-4-3-5-7-15/h18-19H,3-13H2,1-2H3
InChIKeyADNHVXJWISDOCK-UHFFFAOYSA-N
XLogP1.07
TPSA46.94 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.42
LogP ≤ 51.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-[(4-ethylpiperazin-1-yl)methyl]cyclohexan-1-ol
CID 60723383
1-(azetidin-1-ylmethyl)cyclohexan-1-ol
CID 84731810
tert-butyl 4-[(1-hydroxycyclohexyl)methyl]piperazine-1-carboxylate
CID 115750820
1-[(4-cyclopropylpiperazin-1-yl)methyl]cyclohexan-1-ol
CID 63631721
2-[4-[(1-hydroxycyclohexyl)methyl]piperazin-1-yl]acetic acid
CID 65213418
1-[(4-butan-2-ylpiperazin-1-yl)methyl]cyclohexan-1-ol
CID 65208031
3-[1-[(1-hydroxycyclohexyl)methyl]piperidin-4-yl]propanoic acid
CID 65214064
1-[(4-propan-2-ylpiperazin-1-yl)methyl]cyclobutan-1-ol
CID 131701690
1-[(1-hydroxycyclohexyl)methyl]-4-methylpiperidine-4-carbonitrile
CID 113362979
1-(4,4-diethylpiperidin-1-yl)-2-methylpropan-2-ol
CID 63159462
1-[(1-hydroxycyclopentyl)methyl]piperidin-4-ol
CID 65213146
1-[(4-fluoropiperidin-1-yl)methyl]cyclopentan-1-ol
CID 126846312

Frequently Asked Questions

What is the IUPAC name of 1-[[4-(2-hydroxy-2-methylpropyl)piperazin-1-yl]methyl]cyclohexan-1-ol?
The IUPAC name of 1-[[4-(2-hydroxy-2-methylpropyl)piperazin-1-yl]methyl]cyclohexan-1-ol (CID 63632763) is 1-[[4-(2-hydroxy-2-methylpropyl)piperazin-1-yl]methyl]cyclohexan-1-ol.
What is the SMILES notation for 1-[[4-(2-hydroxy-2-methylpropyl)piperazin-1-yl]methyl]cyclohexan-1-ol?
The canonical SMILES for 1-[[4-(2-hydroxy-2-methylpropyl)piperazin-1-yl]methyl]cyclohexan-1-ol is CC(C)(O)CN1CCN(CC2(O)CCCCC2)CC1.
What is the InChIKey of 1-[[4-(2-hydroxy-2-methylpropyl)piperazin-1-yl]methyl]cyclohexan-1-ol?
The InChIKey is ADNHVXJWISDOCK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2O2/c1-14(2,18)12-16-8-10-17(11-9-16)13-15(19)6-4-3-5-7-15/h18-19H,3-13H2,1-2H3.
What are the key properties of 1-[[4-(2-hydroxy-2-methylpropyl)piperazin-1-yl]methyl]cyclohexan-1-ol?
1-[[4-(2-hydroxy-2-methylpropyl)piperazin-1-yl]methyl]cyclohexan-1-ol has a molecular weight of 270.42 g/mol, XLogP of 1.07, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[[4-(2-hydroxy-2-methylpropyl)piperazin-1-yl]methyl]cyclohexan-1-ol is sourced from PubChem (CID 63632763), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).