4-(2-methylbutan-2-yl)-2-(4-propylpiperidin-1-yl)cyclohexan-1-ol

C19H37NO — CID 63472120

IUPAC4-(2-methylbutan-2-yl)-2-(4-propylpiperidin-1-yl)cyclohexan-1-ol
SMILESCCCC1CCN(C2CC(C(C)(C)CC)CCC2O)CC1
InChIInChI=1S/C19H37NO/c1-5-7-15-10-12-20(13-11-15)17-14-16(8-9-18(17)21)19(3,4)6-2/h15-18,21H,5-14H2,1-4H3
InChIKeyHVOUNFZFDDVTTG-UHFFFAOYSA-N
MW295.51 g/mol
LogP4.46
Rot. Bonds5

About 4-(2-methylbutan-2-yl)-2-(4-propylpiperidin-1-yl)cyclohexan-1-ol

4-(2-methylbutan-2-yl)-2-(4-propylpiperidin-1-yl)cyclohexan-1-ol (PubChem CID 63472120) has the molecular formula C19H37NO and a molecular weight of 295.51 g/mol. Its IUPAC name is 4-(2-methylbutan-2-yl)-2-(4-propylpiperidin-1-yl)cyclohexan-1-ol.

Molecular Properties

Compound Name4-(2-methylbutan-2-yl)-2-(4-propylpiperidin-1-yl)cyclohexan-1-ol
PubChem CID63472120
Molecular FormulaC19H37NO
Molecular Weight295.51 g/mol
Exact Mass295.29
IUPAC Name4-(2-methylbutan-2-yl)-2-(4-propylpiperidin-1-yl)cyclohexan-1-ol
SMILESCCCC1CCN(C2CC(C(C)(C)CC)CCC2O)CC1
InChIInChI=1S/C19H37NO/c1-5-7-15-10-12-20(13-11-15)17-14-16(8-9-18(17)21)19(3,4)6-2/h15-18,21H,5-14H2,1-4H3
InChIKeyHVOUNFZFDDVTTG-UHFFFAOYSA-N
XLogP4.46
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.51
LogP ≤ 54.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-(2-methylbutan-2-yl)-2-(4-propylpiperidin-1-yl)cyclohexan-1-ol?
The IUPAC name of 4-(2-methylbutan-2-yl)-2-(4-propylpiperidin-1-yl)cyclohexan-1-ol (CID 63472120) is 4-(2-methylbutan-2-yl)-2-(4-propylpiperidin-1-yl)cyclohexan-1-ol.
What is the SMILES notation for 4-(2-methylbutan-2-yl)-2-(4-propylpiperidin-1-yl)cyclohexan-1-ol?
The canonical SMILES for 4-(2-methylbutan-2-yl)-2-(4-propylpiperidin-1-yl)cyclohexan-1-ol is CCCC1CCN(C2CC(C(C)(C)CC)CCC2O)CC1.
What is the InChIKey of 4-(2-methylbutan-2-yl)-2-(4-propylpiperidin-1-yl)cyclohexan-1-ol?
The InChIKey is HVOUNFZFDDVTTG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H37NO/c1-5-7-15-10-12-20(13-11-15)17-14-16(8-9-18(17)21)19(3,4)6-2/h15-18,21H,5-14H2,1-4H3.
What are the key properties of 4-(2-methylbutan-2-yl)-2-(4-propylpiperidin-1-yl)cyclohexan-1-ol?
4-(2-methylbutan-2-yl)-2-(4-propylpiperidin-1-yl)cyclohexan-1-ol has a molecular weight of 295.51 g/mol, XLogP of 4.46, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-methylbutan-2-yl)-2-(4-propylpiperidin-1-yl)cyclohexan-1-ol is sourced from PubChem (CID 63472120), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).