2-[methyl-[[1-(methylaminomethyl)cyclohexyl]methyl]amino]cyclohexan-1-ol

C16H32N2O — CID 102637079

IUPAC2-[methyl-[[1-(methylaminomethyl)cyclohexyl]methyl]amino]cyclohexan-1-ol
SMILESCNCC1(CN(C)C2CCCCC2O)CCCCC1
InChIInChI=1S/C16H32N2O/c1-17-12-16(10-6-3-7-11-16)13-18(2)14-8-4-5-9-15(14)19/h14-15,17,19H,3-13H2,1-2H3
InChIKeyBYZAHBRXUHVWJW-UHFFFAOYSA-N
MW268.44 g/mol
LogP2.39
Rot. Bonds5

About 2-[methyl-[[1-(methylaminomethyl)cyclohexyl]methyl]amino]cyclohexan-1-ol

2-[methyl-[[1-(methylaminomethyl)cyclohexyl]methyl]amino]cyclohexan-1-ol (PubChem CID 102637079) has the molecular formula C16H32N2O and a molecular weight of 268.44 g/mol. Its IUPAC name is 2-[methyl-[[1-(methylaminomethyl)cyclohexyl]methyl]amino]cyclohexan-1-ol.

Molecular Properties

Compound Name2-[methyl-[[1-(methylaminomethyl)cyclohexyl]methyl]amino]cyclohexan-1-ol
PubChem CID102637079
Molecular FormulaC16H32N2O
Molecular Weight268.44 g/mol
Exact Mass268.25
IUPAC Name2-[methyl-[[1-(methylaminomethyl)cyclohexyl]methyl]amino]cyclohexan-1-ol
SMILESCNCC1(CN(C)C2CCCCC2O)CCCCC1
InChIInChI=1S/C16H32N2O/c1-17-12-16(10-6-3-7-11-16)13-18(2)14-8-4-5-9-15(14)19/h14-15,17,19H,3-13H2,1-2H3
InChIKeyBYZAHBRXUHVWJW-UHFFFAOYSA-N
XLogP2.39
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.44
LogP ≤ 52.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N,2-dimethyl-N-[[1-(methylaminomethyl)cyclohexyl]methyl]cyclohexan-1-amine
CID 62260857
1-[[(2-hydroxycyclohexyl)-methylamino]methyl]cyclohexan-1-ol
CID 102635783
N,2-dimethyl-N-[[1-(methylaminomethyl)cyclopentyl]methyl]oxolan-3-amine
CID 82744009
2-[[3-(hydroxymethyl)oxolan-3-yl]methyl-methylamino]cyclohexan-1-ol
CID 102637107
2-[[3-[(tert-butylamino)methyl]oxolan-3-yl]methyl-methylamino]cyclohexan-1-ol
CID 102637085
2-cyclohexyl-N-methyl-N-[[1-(methylaminomethyl)cyclobutyl]methyl]ethanamine
CID 115246324
N-methyl-N-[[1-(methylaminomethyl)cyclopentyl]methyl]propan-2-amine
CID 62263942
2-[2-hydroxyethyl-[[1-(methylaminomethyl)cyclohexyl]methyl]amino]ethanol
CID 62255853
N-methyl-N-[[1-(methylaminomethyl)cyclopentyl]methyl]-1-phenylmethanamine
CID 55052101
2-[(2-hydroxycyclohexyl)-methylamino]cycloheptan-1-ol
CID 102635791
N-methyl-N-[[1-(methylaminomethyl)cyclopentyl]methyl]-1-(oxan-2-yl)methanamine
CID 62256760
5-[methyl-[[1-(methylaminomethyl)cyclohexyl]methyl]amino]pentan-1-ol
CID 107204564

Frequently Asked Questions

What is the IUPAC name of 2-[methyl-[[1-(methylaminomethyl)cyclohexyl]methyl]amino]cyclohexan-1-ol?
The IUPAC name of 2-[methyl-[[1-(methylaminomethyl)cyclohexyl]methyl]amino]cyclohexan-1-ol (CID 102637079) is 2-[methyl-[[1-(methylaminomethyl)cyclohexyl]methyl]amino]cyclohexan-1-ol.
What is the SMILES notation for 2-[methyl-[[1-(methylaminomethyl)cyclohexyl]methyl]amino]cyclohexan-1-ol?
The canonical SMILES for 2-[methyl-[[1-(methylaminomethyl)cyclohexyl]methyl]amino]cyclohexan-1-ol is CNCC1(CN(C)C2CCCCC2O)CCCCC1.
What is the InChIKey of 2-[methyl-[[1-(methylaminomethyl)cyclohexyl]methyl]amino]cyclohexan-1-ol?
The InChIKey is BYZAHBRXUHVWJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32N2O/c1-17-12-16(10-6-3-7-11-16)13-18(2)14-8-4-5-9-15(14)19/h14-15,17,19H,3-13H2,1-2H3.
What are the key properties of 2-[methyl-[[1-(methylaminomethyl)cyclohexyl]methyl]amino]cyclohexan-1-ol?
2-[methyl-[[1-(methylaminomethyl)cyclohexyl]methyl]amino]cyclohexan-1-ol has a molecular weight of 268.44 g/mol, XLogP of 2.39, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[methyl-[[1-(methylaminomethyl)cyclohexyl]methyl]amino]cyclohexan-1-ol is sourced from PubChem (CID 102637079), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).