2-methyl-N-[[1-(methylaminomethyl)cyclohexyl]methyl]-N-propan-2-ylpropan-1-amine

C16H34N2 — CID 55056164

IUPAC2-methyl-N-[[1-(methylaminomethyl)cyclohexyl]methyl]-N-propan-2-ylpropan-1-amine
SMILESCNCC1(CN(CC(C)C)C(C)C)CCCCC1
InChIInChI=1S/C16H34N2/c1-14(2)11-18(15(3)4)13-16(12-17-5)9-7-6-8-10-16/h14-15,17H,6-13H2,1-5H3
InChIKeyUMNLMJGZLHQMCZ-UHFFFAOYSA-N
MW254.46 g/mol
LogP3.52
Rot. Bonds7

About 2-methyl-N-[[1-(methylaminomethyl)cyclohexyl]methyl]-N-propan-2-ylpropan-1-amine

2-methyl-N-[[1-(methylaminomethyl)cyclohexyl]methyl]-N-propan-2-ylpropan-1-amine (PubChem CID 55056164) has the molecular formula C16H34N2 and a molecular weight of 254.46 g/mol. Its IUPAC name is 2-methyl-N-[[1-(methylaminomethyl)cyclohexyl]methyl]-N-propan-2-ylpropan-1-amine.

Molecular Properties

Compound Name2-methyl-N-[[1-(methylaminomethyl)cyclohexyl]methyl]-N-propan-2-ylpropan-1-amine
PubChem CID55056164
Molecular FormulaC16H34N2
Molecular Weight254.46 g/mol
Exact Mass254.27
IUPAC Name2-methyl-N-[[1-(methylaminomethyl)cyclohexyl]methyl]-N-propan-2-ylpropan-1-amine
SMILESCNCC1(CN(CC(C)C)C(C)C)CCCCC1
InChIInChI=1S/C16H34N2/c1-14(2)11-18(15(3)4)13-16(12-17-5)9-7-6-8-10-16/h14-15,17H,6-13H2,1-5H3
InChIKeyUMNLMJGZLHQMCZ-UHFFFAOYSA-N
XLogP3.52
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.46
LogP ≤ 53.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-methyl-N-[[1-(methylaminomethyl)cyclohexyl]methyl]-N-propan-2-ylpropan-1-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[[1-(methylaminomethyl)cyclohexyl]methyl]-N-propan-2-ylpropan-1-amine?
The IUPAC name of 2-methyl-N-[[1-(methylaminomethyl)cyclohexyl]methyl]-N-propan-2-ylpropan-1-amine (CID 55056164) is 2-methyl-N-[[1-(methylaminomethyl)cyclohexyl]methyl]-N-propan-2-ylpropan-1-amine.
What is the SMILES notation for 2-methyl-N-[[1-(methylaminomethyl)cyclohexyl]methyl]-N-propan-2-ylpropan-1-amine?
The canonical SMILES for 2-methyl-N-[[1-(methylaminomethyl)cyclohexyl]methyl]-N-propan-2-ylpropan-1-amine is CNCC1(CN(CC(C)C)C(C)C)CCCCC1.
What is the InChIKey of 2-methyl-N-[[1-(methylaminomethyl)cyclohexyl]methyl]-N-propan-2-ylpropan-1-amine?
The InChIKey is UMNLMJGZLHQMCZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H34N2/c1-14(2)11-18(15(3)4)13-16(12-17-5)9-7-6-8-10-16/h14-15,17H,6-13H2,1-5H3.
What are the key properties of 2-methyl-N-[[1-(methylaminomethyl)cyclohexyl]methyl]-N-propan-2-ylpropan-1-amine?
2-methyl-N-[[1-(methylaminomethyl)cyclohexyl]methyl]-N-propan-2-ylpropan-1-amine has a molecular weight of 254.46 g/mol, XLogP of 3.52, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[[1-(methylaminomethyl)cyclohexyl]methyl]-N-propan-2-ylpropan-1-amine is sourced from PubChem (CID 55056164), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).