1-[[(2-hydroxycyclohexyl)-methylamino]methyl]cyclohexan-1-ol

C14H27NO2 — CID 102635783

IUPAC1-[[(2-hydroxycyclohexyl)-methylamino]methyl]cyclohexan-1-ol
SMILESCN(CC1(O)CCCCC1)C1CCCCC1O
InChIInChI=1S/C14H27NO2/c1-15(12-7-3-4-8-13(12)16)11-14(17)9-5-2-6-10-14/h12-13,16-17H,2-11H2,1H3
InChIKeyRPODDEPOTXLBCZ-UHFFFAOYSA-N
MW241.37 g/mol
LogP1.92
Rot. Bonds3

About 1-[[(2-hydroxycyclohexyl)-methylamino]methyl]cyclohexan-1-ol

1-[[(2-hydroxycyclohexyl)-methylamino]methyl]cyclohexan-1-ol (PubChem CID 102635783) has the molecular formula C14H27NO2 and a molecular weight of 241.37 g/mol. Its IUPAC name is 1-[[(2-hydroxycyclohexyl)-methylamino]methyl]cyclohexan-1-ol.

Molecular Properties

Compound Name1-[[(2-hydroxycyclohexyl)-methylamino]methyl]cyclohexan-1-ol
PubChem CID102635783
Molecular FormulaC14H27NO2
Molecular Weight241.37 g/mol
Exact Mass241.20
IUPAC Name1-[[(2-hydroxycyclohexyl)-methylamino]methyl]cyclohexan-1-ol
SMILESCN(CC1(O)CCCCC1)C1CCCCC1O
InChIInChI=1S/C14H27NO2/c1-15(12-7-3-4-8-13(12)16)11-14(17)9-5-2-6-10-14/h12-13,16-17H,2-11H2,1H3
InChIKeyRPODDEPOTXLBCZ-UHFFFAOYSA-N
XLogP1.92
TPSA43.70 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.37
LogP ≤ 51.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[methyl-[[1-(methylaminomethyl)cyclohexyl]methyl]amino]cyclohexan-1-ol
CID 102637079
2-[[(1-hydroxycyclopentyl)methyl-methylamino]methyl]cyclohexan-1-ol
CID 113356313
1-[[methyl-[4-(methylamino)cyclohexyl]amino]methyl]cyclohexan-1-ol
CID 79122134
1-[(dimethylamino)methyl]cycloheptan-1-ol
CID 104550048
2-[(2-hydroxycyclohexyl)-methylamino]cycloheptan-1-ol
CID 102635791
2-[[3-(hydroxymethyl)oxolan-3-yl]methyl-methylamino]cyclohexan-1-ol
CID 102637107
3-[[(1S,2S)-2-hydroxycyclohexyl]-methylamino]propanenitrile
CID 102731792
4-[[(2-hydroxycyclohexyl)-methylamino]methyl]oxane-4-carbaldehyde
CID 102636939
2-[cyclopropylmethyl(methyl)amino]cyclopentan-1-ol
CID 60985143
2-[(1-hydroxycyclopentyl)methyl-methylamino]cyclohexan-1-one
CID 114950414
trans-(1S,2S)-2-[methyl-[(2-methylcyclopropyl)methyl]amino]cyclohexan-1-ol
CID 102732161
2-[2,2-difluoroethyl(methyl)amino]cyclohexan-1-ol
CID 115773222

Frequently Asked Questions

What is the IUPAC name of 1-[[(2-hydroxycyclohexyl)-methylamino]methyl]cyclohexan-1-ol?
The IUPAC name of 1-[[(2-hydroxycyclohexyl)-methylamino]methyl]cyclohexan-1-ol (CID 102635783) is 1-[[(2-hydroxycyclohexyl)-methylamino]methyl]cyclohexan-1-ol.
What is the SMILES notation for 1-[[(2-hydroxycyclohexyl)-methylamino]methyl]cyclohexan-1-ol?
The canonical SMILES for 1-[[(2-hydroxycyclohexyl)-methylamino]methyl]cyclohexan-1-ol is CN(CC1(O)CCCCC1)C1CCCCC1O.
What is the InChIKey of 1-[[(2-hydroxycyclohexyl)-methylamino]methyl]cyclohexan-1-ol?
The InChIKey is RPODDEPOTXLBCZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27NO2/c1-15(12-7-3-4-8-13(12)16)11-14(17)9-5-2-6-10-14/h12-13,16-17H,2-11H2,1H3.
What are the key properties of 1-[[(2-hydroxycyclohexyl)-methylamino]methyl]cyclohexan-1-ol?
1-[[(2-hydroxycyclohexyl)-methylamino]methyl]cyclohexan-1-ol has a molecular weight of 241.37 g/mol, XLogP of 1.92, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[[(2-hydroxycyclohexyl)-methylamino]methyl]cyclohexan-1-ol is sourced from PubChem (CID 102635783), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).