1-[(4-methoxycyclohexyl)methyl]-2-methylpiperidin-4-ol

C14H27NO2 — CID 155302698

IUPAC1-[(4-methoxycyclohexyl)methyl]-2-methylpiperidin-4-ol
SMILESCOC1CCC(CN2CCC(O)CC2C)CC1
InChIInChI=1S/C14H27NO2/c1-11-9-13(16)7-8-15(11)10-12-3-5-14(17-2)6-4-12/h11-14,16H,3-10H2,1-2H3
InChIKeyFRCIBHSNIZSVMU-UHFFFAOYSA-N
MW241.37 g/mol
LogP2.04
Rot. Bonds3

About 1-[(4-methoxycyclohexyl)methyl]-2-methylpiperidin-4-ol

1-[(4-methoxycyclohexyl)methyl]-2-methylpiperidin-4-ol (PubChem CID 155302698) has the molecular formula C14H27NO2 and a molecular weight of 241.37 g/mol. Its IUPAC name is 1-[(4-methoxycyclohexyl)methyl]-2-methylpiperidin-4-ol.

Molecular Properties

Compound Name1-[(4-methoxycyclohexyl)methyl]-2-methylpiperidin-4-ol
PubChem CID155302698
Molecular FormulaC14H27NO2
Molecular Weight241.37 g/mol
Exact Mass241.20
IUPAC Name1-[(4-methoxycyclohexyl)methyl]-2-methylpiperidin-4-ol
SMILESCOC1CCC(CN2CCC(O)CC2C)CC1
InChIInChI=1S/C14H27NO2/c1-11-9-13(16)7-8-15(11)10-12-3-5-14(17-2)6-4-12/h11-14,16H,3-10H2,1-2H3
InChIKeyFRCIBHSNIZSVMU-UHFFFAOYSA-N
XLogP2.04
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.37
LogP ≤ 52.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-[(4-methoxycyclohexyl)methyl]-2-methylpiperidin-4-ol?
The IUPAC name of 1-[(4-methoxycyclohexyl)methyl]-2-methylpiperidin-4-ol (CID 155302698) is 1-[(4-methoxycyclohexyl)methyl]-2-methylpiperidin-4-ol.
What is the SMILES notation for 1-[(4-methoxycyclohexyl)methyl]-2-methylpiperidin-4-ol?
The canonical SMILES for 1-[(4-methoxycyclohexyl)methyl]-2-methylpiperidin-4-ol is COC1CCC(CN2CCC(O)CC2C)CC1.
What is the InChIKey of 1-[(4-methoxycyclohexyl)methyl]-2-methylpiperidin-4-ol?
The InChIKey is FRCIBHSNIZSVMU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27NO2/c1-11-9-13(16)7-8-15(11)10-12-3-5-14(17-2)6-4-12/h11-14,16H,3-10H2,1-2H3.
What are the key properties of 1-[(4-methoxycyclohexyl)methyl]-2-methylpiperidin-4-ol?
1-[(4-methoxycyclohexyl)methyl]-2-methylpiperidin-4-ol has a molecular weight of 241.37 g/mol, XLogP of 2.04, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(4-methoxycyclohexyl)methyl]-2-methylpiperidin-4-ol is sourced from PubChem (CID 155302698), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).