1,2,2,6,6-pentamethyl-3-[(2-methylcyclohexyl)methyl]piperidin-4-ol

C18H35NO — CID 19784678

IUPAC1,2,2,6,6-pentamethyl-3-[(2-methylcyclohexyl)methyl]piperidin-4-ol
SMILESCC1CCCCC1CC1C(O)CC(C)(C)N(C)C1(C)C
InChIInChI=1S/C18H35NO/c1-13-9-7-8-10-14(13)11-15-16(20)12-17(2,3)19(6)18(15,4)5/h13-16,20H,7-12H2,1-6H3
InChIKeyRFYNZOGCYKDEHD-UHFFFAOYSA-N
MW281.48 g/mol
LogP4.07
Rot. Bonds2

About 1,2,2,6,6-pentamethyl-3-[(2-methylcyclohexyl)methyl]piperidin-4-ol

1,2,2,6,6-pentamethyl-3-[(2-methylcyclohexyl)methyl]piperidin-4-ol (PubChem CID 19784678) has the molecular formula C18H35NO and a molecular weight of 281.48 g/mol. Its IUPAC name is 1,2,2,6,6-pentamethyl-3-[(2-methylcyclohexyl)methyl]piperidin-4-ol.

Molecular Properties

Compound Name1,2,2,6,6-pentamethyl-3-[(2-methylcyclohexyl)methyl]piperidin-4-ol
PubChem CID19784678
Molecular FormulaC18H35NO
Molecular Weight281.48 g/mol
Exact Mass281.27
IUPAC Name1,2,2,6,6-pentamethyl-3-[(2-methylcyclohexyl)methyl]piperidin-4-ol
SMILESCC1CCCCC1CC1C(O)CC(C)(C)N(C)C1(C)C
InChIInChI=1S/C18H35NO/c1-13-9-7-8-10-14(13)11-15-16(20)12-17(2,3)19(6)18(15,4)5/h13-16,20H,7-12H2,1-6H3
InChIKeyRFYNZOGCYKDEHD-UHFFFAOYSA-N
XLogP4.07
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
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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Frequently Asked Questions

What is the IUPAC name of 1,2,2,6,6-pentamethyl-3-[(2-methylcyclohexyl)methyl]piperidin-4-ol?
The IUPAC name of 1,2,2,6,6-pentamethyl-3-[(2-methylcyclohexyl)methyl]piperidin-4-ol (CID 19784678) is 1,2,2,6,6-pentamethyl-3-[(2-methylcyclohexyl)methyl]piperidin-4-ol.
What is the SMILES notation for 1,2,2,6,6-pentamethyl-3-[(2-methylcyclohexyl)methyl]piperidin-4-ol?
The canonical SMILES for 1,2,2,6,6-pentamethyl-3-[(2-methylcyclohexyl)methyl]piperidin-4-ol is CC1CCCCC1CC1C(O)CC(C)(C)N(C)C1(C)C.
What is the InChIKey of 1,2,2,6,6-pentamethyl-3-[(2-methylcyclohexyl)methyl]piperidin-4-ol?
The InChIKey is RFYNZOGCYKDEHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H35NO/c1-13-9-7-8-10-14(13)11-15-16(20)12-17(2,3)19(6)18(15,4)5/h13-16,20H,7-12H2,1-6H3.
What are the key properties of 1,2,2,6,6-pentamethyl-3-[(2-methylcyclohexyl)methyl]piperidin-4-ol?
1,2,2,6,6-pentamethyl-3-[(2-methylcyclohexyl)methyl]piperidin-4-ol has a molecular weight of 281.48 g/mol, XLogP of 4.07, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2,2,6,6-pentamethyl-3-[(2-methylcyclohexyl)methyl]piperidin-4-ol is sourced from PubChem (CID 19784678), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).