4-propan-2-yl-1-[(1-propan-2-ylpiperidin-4-yl)methyl]cyclohexan-1-ol

C18H35NO — CID 170951892

IUPAC4-propan-2-yl-1-[(1-propan-2-ylpiperidin-4-yl)methyl]cyclohexan-1-ol
SMILESCC(C)C1CCC(O)(CC2CCN(C(C)C)CC2)CC1
InChIInChI=1S/C18H35NO/c1-14(2)17-5-9-18(20,10-6-17)13-16-7-11-19(12-8-16)15(3)4/h14-17,20H,5-13H2,1-4H3
InChIKeyGZECLDSDRISYLK-UHFFFAOYSA-N
MW281.48 g/mol
LogP4.07
Rot. Bonds4

About 4-propan-2-yl-1-[(1-propan-2-ylpiperidin-4-yl)methyl]cyclohexan-1-ol

4-propan-2-yl-1-[(1-propan-2-ylpiperidin-4-yl)methyl]cyclohexan-1-ol (PubChem CID 170951892) has the molecular formula C18H35NO and a molecular weight of 281.48 g/mol. Its IUPAC name is 4-propan-2-yl-1-[(1-propan-2-ylpiperidin-4-yl)methyl]cyclohexan-1-ol.

Molecular Properties

Compound Name4-propan-2-yl-1-[(1-propan-2-ylpiperidin-4-yl)methyl]cyclohexan-1-ol
PubChem CID170951892
Molecular FormulaC18H35NO
Molecular Weight281.48 g/mol
Exact Mass281.27
IUPAC Name4-propan-2-yl-1-[(1-propan-2-ylpiperidin-4-yl)methyl]cyclohexan-1-ol
SMILESCC(C)C1CCC(O)(CC2CCN(C(C)C)CC2)CC1
InChIInChI=1S/C18H35NO/c1-14(2)17-5-9-18(20,10-6-17)13-16-7-11-19(12-8-16)15(3)4/h14-17,20H,5-13H2,1-4H3
InChIKeyGZECLDSDRISYLK-UHFFFAOYSA-N
XLogP4.07
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.48
LogP ≤ 54.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-[4-[(4-hydroxy-1-propan-2-ylpiperidin-4-yl)methyl]piperidin-1-yl]ethanone
CID 177354667
1,4-di(propan-2-yl)piperidine
CID 21303253
3,9-di(propan-2-yl)-3-azaspiro[5.5]undecane;ethane
CID 154680928
butane;1,4-di(propan-2-yl)piperazine;1,4-di(propan-2-yl)piperidine;ethane
CID 168928365
1-propan-2-yl-4-[(1-propan-2-ylpiperidin-4-yl)methyl]piperazine;1-propan-2-yl-4-[(4-propan-2-ylpiperidin-1-yl)methyl]piperidine
CID 167695333
4-(2-cyclopropylethyl)-1-propan-2-ylpiperidin-4-ol
CID 106590391
[4-(cyclopropylmethyl)-1-propan-2-ylpiperidin-4-yl]methanol
CID 58547558
[2-[(1-propan-2-ylpiperidin-4-yl)methyl]pyrrolidin-2-yl]methanol
CID 115103198
1-(cyclohexylmethyl)-3-propan-2-ylcyclobutan-1-ol
CID 103563992
ethane;1-[4-fluoro-4-[(1-propan-2-ylpiperidin-4-yl)methyl]piperidin-1-yl]-2-methylpropan-1-one
CID 177354793
2-[(1-propan-2-ylpiperidin-4-yl)methyl]piperidine-2-carboxylic acid
CID 115103561
3-propan-2-yl-9-[(1-propan-2-ylpiperidin-4-yl)methyl]-3,9-diazaspiro[5.5]undecane
CID 155184308

Frequently Asked Questions

What is the IUPAC name of 4-propan-2-yl-1-[(1-propan-2-ylpiperidin-4-yl)methyl]cyclohexan-1-ol?
The IUPAC name of 4-propan-2-yl-1-[(1-propan-2-ylpiperidin-4-yl)methyl]cyclohexan-1-ol (CID 170951892) is 4-propan-2-yl-1-[(1-propan-2-ylpiperidin-4-yl)methyl]cyclohexan-1-ol.
What is the SMILES notation for 4-propan-2-yl-1-[(1-propan-2-ylpiperidin-4-yl)methyl]cyclohexan-1-ol?
The canonical SMILES for 4-propan-2-yl-1-[(1-propan-2-ylpiperidin-4-yl)methyl]cyclohexan-1-ol is CC(C)C1CCC(O)(CC2CCN(C(C)C)CC2)CC1.
What is the InChIKey of 4-propan-2-yl-1-[(1-propan-2-ylpiperidin-4-yl)methyl]cyclohexan-1-ol?
The InChIKey is GZECLDSDRISYLK-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H35NO/c1-14(2)17-5-9-18(20,10-6-17)13-16-7-11-19(12-8-16)15(3)4/h14-17,20H,5-13H2,1-4H3.
What are the key properties of 4-propan-2-yl-1-[(1-propan-2-ylpiperidin-4-yl)methyl]cyclohexan-1-ol?
4-propan-2-yl-1-[(1-propan-2-ylpiperidin-4-yl)methyl]cyclohexan-1-ol has a molecular weight of 281.48 g/mol, XLogP of 4.07, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-propan-2-yl-1-[(1-propan-2-ylpiperidin-4-yl)methyl]cyclohexan-1-ol is sourced from PubChem (CID 170951892), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).