2-cyclohexyl-N-methyl-N-[[1-(methylaminomethyl)cyclobutyl]methyl]ethanamine

C16H32N2 — CID 115246324

IUPAC2-cyclohexyl-N-methyl-N-[[1-(methylaminomethyl)cyclobutyl]methyl]ethanamine
SMILESCNCC1(CN(C)CCC2CCCCC2)CCC1
InChIInChI=1S/C16H32N2/c1-17-13-16(10-6-11-16)14-18(2)12-9-15-7-4-3-5-8-15/h15,17H,3-14H2,1-2H3
InChIKeyXLTLTJRLOAHPNP-UHFFFAOYSA-N
MW252.45 g/mol
LogP3.28
Rot. Bonds7

About 2-cyclohexyl-N-methyl-N-[[1-(methylaminomethyl)cyclobutyl]methyl]ethanamine

2-cyclohexyl-N-methyl-N-[[1-(methylaminomethyl)cyclobutyl]methyl]ethanamine (PubChem CID 115246324) has the molecular formula C16H32N2 and a molecular weight of 252.45 g/mol. Its IUPAC name is 2-cyclohexyl-N-methyl-N-[[1-(methylaminomethyl)cyclobutyl]methyl]ethanamine.

Molecular Properties

Compound Name2-cyclohexyl-N-methyl-N-[[1-(methylaminomethyl)cyclobutyl]methyl]ethanamine
PubChem CID115246324
Molecular FormulaC16H32N2
Molecular Weight252.45 g/mol
Exact Mass252.26
IUPAC Name2-cyclohexyl-N-methyl-N-[[1-(methylaminomethyl)cyclobutyl]methyl]ethanamine
SMILESCNCC1(CN(C)CCC2CCCCC2)CCC1
InChIInChI=1S/C16H32N2/c1-17-13-16(10-6-11-16)14-18(2)12-9-15-7-4-3-5-8-15/h15,17H,3-14H2,1-2H3
InChIKeyXLTLTJRLOAHPNP-UHFFFAOYSA-N
XLogP3.28
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.45
LogP ≤ 53.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-methyl-N-[[1-(methylaminomethyl)cyclopropyl]methyl]-2-(1-methylpiperidin-3-yl)ethanamine
CID 115244956
N-methyl-N-[[1-(methylaminomethyl)cyclohexyl]methyl]pentan-1-amine
CID 62264045
2-methoxy-N-methyl-N-[[1-(methylaminomethyl)cyclohexyl]methyl]ethanamine
CID 62259359
5-[methyl-[[1-(methylaminomethyl)cyclohexyl]methyl]amino]pentan-1-ol
CID 107204564
N,2-dimethyl-N-[[1-(methylaminomethyl)cyclohexyl]methyl]cyclohexan-1-amine
CID 62260857
N-methyl-N-[[1-(methylaminomethyl)cyclopentyl]methyl]-1-(oxan-2-yl)methanamine
CID 62256760
2-(4-bromophenyl)-N-methyl-N-[[1-(methylaminomethyl)cyclobutyl]methyl]ethanamine
CID 115246309
2-[methyl-[[1-(methylaminomethyl)cyclohexyl]methyl]amino]cyclohexan-1-ol
CID 102637079
3-cyclopentyl-N-[[1-(methylaminomethyl)cyclobutyl]methyl]propanamide
CID 115272150
4-[[2-cyclohexylethyl(methyl)amino]methyl]-N-methylcyclohexan-1-amine
CID 115213754
[1-[[cyclohexylmethyl(methyl)amino]methyl]cyclobutyl]methanol
CID 115247051
N-[[1-[[cyclopentylmethyl(methyl)amino]methyl]cyclopentyl]methyl]cyclopropanamine
CID 63633194

Frequently Asked Questions

What is the IUPAC name of 2-cyclohexyl-N-methyl-N-[[1-(methylaminomethyl)cyclobutyl]methyl]ethanamine?
The IUPAC name of 2-cyclohexyl-N-methyl-N-[[1-(methylaminomethyl)cyclobutyl]methyl]ethanamine (CID 115246324) is 2-cyclohexyl-N-methyl-N-[[1-(methylaminomethyl)cyclobutyl]methyl]ethanamine.
What is the SMILES notation for 2-cyclohexyl-N-methyl-N-[[1-(methylaminomethyl)cyclobutyl]methyl]ethanamine?
The canonical SMILES for 2-cyclohexyl-N-methyl-N-[[1-(methylaminomethyl)cyclobutyl]methyl]ethanamine is CNCC1(CN(C)CCC2CCCCC2)CCC1.
What is the InChIKey of 2-cyclohexyl-N-methyl-N-[[1-(methylaminomethyl)cyclobutyl]methyl]ethanamine?
The InChIKey is XLTLTJRLOAHPNP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32N2/c1-17-13-16(10-6-11-16)14-18(2)12-9-15-7-4-3-5-8-15/h15,17H,3-14H2,1-2H3.
What are the key properties of 2-cyclohexyl-N-methyl-N-[[1-(methylaminomethyl)cyclobutyl]methyl]ethanamine?
2-cyclohexyl-N-methyl-N-[[1-(methylaminomethyl)cyclobutyl]methyl]ethanamine has a molecular weight of 252.45 g/mol, XLogP of 3.28, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclohexyl-N-methyl-N-[[1-(methylaminomethyl)cyclobutyl]methyl]ethanamine is sourced from PubChem (CID 115246324), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).