1-cyclopentyl-2-[(4-methylpiperazin-1-yl)methyl]cyclohexan-1-ol

C17H32N2O — CID 10149392

IUPAC1-cyclopentyl-2-[(4-methylpiperazin-1-yl)methyl]cyclohexan-1-ol
SMILESCN1CCN(CC2CCCCC2(O)C2CCCC2)CC1
InChIInChI=1S/C17H32N2O/c1-18-10-12-19(13-11-18)14-16-8-4-5-9-17(16,20)15-6-2-3-7-15/h15-16,20H,2-14H2,1H3
InChIKeyUTVLUGHHHPRRJU-UHFFFAOYSA-N
MW280.46 g/mol
LogP2.35
Rot. Bonds3

About 1-cyclopentyl-2-[(4-methylpiperazin-1-yl)methyl]cyclohexan-1-ol

1-cyclopentyl-2-[(4-methylpiperazin-1-yl)methyl]cyclohexan-1-ol (PubChem CID 10149392) has the molecular formula C17H32N2O and a molecular weight of 280.46 g/mol. Its IUPAC name is 1-cyclopentyl-2-[(4-methylpiperazin-1-yl)methyl]cyclohexan-1-ol.

Molecular Properties

Compound Name1-cyclopentyl-2-[(4-methylpiperazin-1-yl)methyl]cyclohexan-1-ol
PubChem CID10149392
Molecular FormulaC17H32N2O
Molecular Weight280.46 g/mol
Exact Mass280.25
IUPAC Name1-cyclopentyl-2-[(4-methylpiperazin-1-yl)methyl]cyclohexan-1-ol
SMILESCN1CCN(CC2CCCCC2(O)C2CCCC2)CC1
InChIInChI=1S/C17H32N2O/c1-18-10-12-19(13-11-18)14-16-8-4-5-9-17(16,20)15-6-2-3-7-15/h15-16,20H,2-14H2,1H3
InChIKeyUTVLUGHHHPRRJU-UHFFFAOYSA-N
XLogP2.35
TPSA26.71 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.46
LogP ≤ 52.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-cyclopentyl-2-[(4-methylpiperazin-1-yl)methyl]cyclohexan-1-ol with MolForge

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Related Compounds

4-Cyclohexyl-1-methylpiperid-4-ol
CID 115390
3-Cyclohexyl-2-methyl-1-piperidin-1-ylpentan-3-ol
CID 10125346
3-Cyclopentyl-2-methyl-1-piperidin-1-ylpentan-3-ol
CID 10149228
1-Cyclopentyl-2-[(4-methylpiperazin-1-yl)methyl]cyclooctan-1-ol
CID 10171846
3-Cyclohexyl-2-methyl-1-(4-methylpiperazin-1-yl)pentan-3-ol
CID 10214772
1-Cyclopentyl-2,6-bis(piperidin-1-ylmethyl)cyclohexan-1-ol
CID 10215625
1-Cyclopentyl-2-[(4-methylpiperazin-1-yl)methyl]cycloheptan-1-ol
CID 10236440
1-Cyclohexyl-2-(piperidin-1-ylmethyl)cyclododecan-1-ol
CID 10237150
1-Cyclohexyl-2-[(4-methylpiperazin-1-yl)methyl]cyclohexan-1-ol
CID 10286251
3-Cyclopentyl-2-methyl-1-(4-methylpiperazin-1-yl)pentan-3-ol
CID 10308174
1-Cyclopentyl-2-(piperidin-1-ylmethyl)cyclododecan-1-ol
CID 10308929
1-(Cyclohexylmethyl)-2-[(4-methylpiperazin-1-yl)methyl]cyclooctan-1-ol
CID 17962704

Frequently Asked Questions

What is the IUPAC name of 1-cyclopentyl-2-[(4-methylpiperazin-1-yl)methyl]cyclohexan-1-ol?
The IUPAC name of 1-cyclopentyl-2-[(4-methylpiperazin-1-yl)methyl]cyclohexan-1-ol (CID 10149392) is 1-cyclopentyl-2-[(4-methylpiperazin-1-yl)methyl]cyclohexan-1-ol.
What is the SMILES notation for 1-cyclopentyl-2-[(4-methylpiperazin-1-yl)methyl]cyclohexan-1-ol?
The canonical SMILES for 1-cyclopentyl-2-[(4-methylpiperazin-1-yl)methyl]cyclohexan-1-ol is CN1CCN(CC2CCCCC2(O)C2CCCC2)CC1.
What is the InChIKey of 1-cyclopentyl-2-[(4-methylpiperazin-1-yl)methyl]cyclohexan-1-ol?
The InChIKey is UTVLUGHHHPRRJU-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H32N2O/c1-18-10-12-19(13-11-18)14-16-8-4-5-9-17(16,20)15-6-2-3-7-15/h15-16,20H,2-14H2,1H3.
What are the key properties of 1-cyclopentyl-2-[(4-methylpiperazin-1-yl)methyl]cyclohexan-1-ol?
1-cyclopentyl-2-[(4-methylpiperazin-1-yl)methyl]cyclohexan-1-ol has a molecular weight of 280.46 g/mol, XLogP of 2.35, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentyl-2-[(4-methylpiperazin-1-yl)methyl]cyclohexan-1-ol is sourced from PubChem (CID 10149392), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).