4-[[methyl-(1-methylpiperidin-4-yl)amino]methyl]cyclohexan-1-ol

C14H28N2O — CID 115239845

IUPAC4-[[methyl-(1-methylpiperidin-4-yl)amino]methyl]cyclohexan-1-ol
SMILESCN1CCC(N(C)CC2CCC(O)CC2)CC1
InChIInChI=1S/C14H28N2O/c1-15-9-7-13(8-10-15)16(2)11-12-3-5-14(17)6-4-12/h12-14,17H,3-11H2,1-2H3
InChIKeyDSHSLDYGAXZSEA-UHFFFAOYSA-N
MW240.39 g/mol
LogP1.56
Rot. Bonds3

About 4-[[methyl-(1-methylpiperidin-4-yl)amino]methyl]cyclohexan-1-ol

4-[[methyl-(1-methylpiperidin-4-yl)amino]methyl]cyclohexan-1-ol (PubChem CID 115239845) has the molecular formula C14H28N2O and a molecular weight of 240.39 g/mol. Its IUPAC name is 4-[[methyl-(1-methylpiperidin-4-yl)amino]methyl]cyclohexan-1-ol.

Molecular Properties

Compound Name4-[[methyl-(1-methylpiperidin-4-yl)amino]methyl]cyclohexan-1-ol
PubChem CID115239845
Molecular FormulaC14H28N2O
Molecular Weight240.39 g/mol
Exact Mass240.22
IUPAC Name4-[[methyl-(1-methylpiperidin-4-yl)amino]methyl]cyclohexan-1-ol
SMILESCN1CCC(N(C)CC2CCC(O)CC2)CC1
InChIInChI=1S/C14H28N2O/c1-15-9-7-13(8-10-15)16(2)11-12-3-5-14(17)6-4-12/h12-14,17H,3-11H2,1-2H3
InChIKeyDSHSLDYGAXZSEA-UHFFFAOYSA-N
XLogP1.56
TPSA26.71 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.39
LogP ≤ 51.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-[[methyl-(1-methylpiperidin-4-yl)amino]methyl]cyclohexan-1-ol?
The IUPAC name of 4-[[methyl-(1-methylpiperidin-4-yl)amino]methyl]cyclohexan-1-ol (CID 115239845) is 4-[[methyl-(1-methylpiperidin-4-yl)amino]methyl]cyclohexan-1-ol.
What is the SMILES notation for 4-[[methyl-(1-methylpiperidin-4-yl)amino]methyl]cyclohexan-1-ol?
The canonical SMILES for 4-[[methyl-(1-methylpiperidin-4-yl)amino]methyl]cyclohexan-1-ol is CN1CCC(N(C)CC2CCC(O)CC2)CC1.
What is the InChIKey of 4-[[methyl-(1-methylpiperidin-4-yl)amino]methyl]cyclohexan-1-ol?
The InChIKey is DSHSLDYGAXZSEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O/c1-15-9-7-13(8-10-15)16(2)11-12-3-5-14(17)6-4-12/h12-14,17H,3-11H2,1-2H3.
What are the key properties of 4-[[methyl-(1-methylpiperidin-4-yl)amino]methyl]cyclohexan-1-ol?
4-[[methyl-(1-methylpiperidin-4-yl)amino]methyl]cyclohexan-1-ol has a molecular weight of 240.39 g/mol, XLogP of 1.56, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[methyl-(1-methylpiperidin-4-yl)amino]methyl]cyclohexan-1-ol is sourced from PubChem (CID 115239845), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).