2-[cyclobutyl-[[2-(methylamino)cyclohexyl]methyl]amino]ethanol

C14H28N2O — CID 102870950

IUPAC2-[cyclobutyl-[[2-(methylamino)cyclohexyl]methyl]amino]ethanol
SMILESCNC1CCCCC1CN(CCO)C1CCC1
InChIInChI=1S/C14H28N2O/c1-15-14-8-3-2-5-12(14)11-16(9-10-17)13-6-4-7-13/h12-15,17H,2-11H2,1H3
InChIKeyBPXXDFKEMMCZIM-UHFFFAOYSA-N
MW240.39 g/mol
LogP1.61
Rot. Bonds6

About 2-[cyclobutyl-[[2-(methylamino)cyclohexyl]methyl]amino]ethanol

2-[cyclobutyl-[[2-(methylamino)cyclohexyl]methyl]amino]ethanol (PubChem CID 102870950) has the molecular formula C14H28N2O and a molecular weight of 240.39 g/mol. Its IUPAC name is 2-[cyclobutyl-[[2-(methylamino)cyclohexyl]methyl]amino]ethanol.

Molecular Properties

Compound Name2-[cyclobutyl-[[2-(methylamino)cyclohexyl]methyl]amino]ethanol
PubChem CID102870950
Molecular FormulaC14H28N2O
Molecular Weight240.39 g/mol
Exact Mass240.22
IUPAC Name2-[cyclobutyl-[[2-(methylamino)cyclohexyl]methyl]amino]ethanol
SMILESCNC1CCCCC1CN(CCO)C1CCC1
InChIInChI=1S/C14H28N2O/c1-15-14-8-3-2-5-12(14)11-16(9-10-17)13-6-4-7-13/h12-15,17H,2-11H2,1H3
InChIKeyBPXXDFKEMMCZIM-UHFFFAOYSA-N
XLogP1.61
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.39
LogP ≤ 51.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[cyclobutyl-[[2-(ethylamino)cyclohexyl]methyl]amino]ethanol
CID 102871036
2-[cyclohexyl-[[4-(methylamino)oxan-3-yl]methyl]amino]ethanol
CID 103059443
2-[cyclopentyl-[[2-(methylamino)-5-propan-2-ylcyclohexyl]methyl]amino]ethanol
CID 62704902
2-[[cyclopentyl(ethyl)amino]methyl]-N-methylcycloheptan-1-amine
CID 62615779
2-[cyclobutyl-[[5-ethyl-2-(methylamino)cyclohexyl]methyl]amino]ethanol
CID 102870906
2-[[cyclopropyl(3-methylbutyl)amino]methyl]-N-methylcyclopentan-1-amine
CID 78991239
2-[[cyclopropyl(cyclopropylmethyl)amino]methyl]-N-methylcyclopentan-1-amine
CID 64519877
2-[cyclopropyl-[(2-methylcyclohexyl)methyl]amino]ethanol
CID 104517048
2-[(2-aminocycloheptyl)methyl-cyclobutylamino]ethanol
CID 102870978
2-[cyclopropyl-[[2-(methylamino)-5-propan-2-ylcyclohexyl]methyl]amino]ethanol
CID 62708874
2-[cyclopropyl-[[2-(methylamino)-5-propylcyclohexyl]methyl]amino]ethanol
CID 55094432
N-methyl-N-[[2-(methylamino)cyclohexyl]methyl]cycloheptanamine
CID 62614949

Frequently Asked Questions

What is the IUPAC name of 2-[cyclobutyl-[[2-(methylamino)cyclohexyl]methyl]amino]ethanol?
The IUPAC name of 2-[cyclobutyl-[[2-(methylamino)cyclohexyl]methyl]amino]ethanol (CID 102870950) is 2-[cyclobutyl-[[2-(methylamino)cyclohexyl]methyl]amino]ethanol.
What is the SMILES notation for 2-[cyclobutyl-[[2-(methylamino)cyclohexyl]methyl]amino]ethanol?
The canonical SMILES for 2-[cyclobutyl-[[2-(methylamino)cyclohexyl]methyl]amino]ethanol is CNC1CCCCC1CN(CCO)C1CCC1.
What is the InChIKey of 2-[cyclobutyl-[[2-(methylamino)cyclohexyl]methyl]amino]ethanol?
The InChIKey is BPXXDFKEMMCZIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O/c1-15-14-8-3-2-5-12(14)11-16(9-10-17)13-6-4-7-13/h12-15,17H,2-11H2,1H3.
What are the key properties of 2-[cyclobutyl-[[2-(methylamino)cyclohexyl]methyl]amino]ethanol?
2-[cyclobutyl-[[2-(methylamino)cyclohexyl]methyl]amino]ethanol has a molecular weight of 240.39 g/mol, XLogP of 1.61, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[cyclobutyl-[[2-(methylamino)cyclohexyl]methyl]amino]ethanol is sourced from PubChem (CID 102870950), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).