N-methyl-N-[[4-(methylaminomethyl)oxan-4-yl]methyl]cyclohexanamine

C15H30N2O — CID 55066283

IUPACN-methyl-N-[[4-(methylaminomethyl)oxan-4-yl]methyl]cyclohexanamine
SMILESCNCC1(CN(C)C2CCCCC2)CCOCC1
InChIInChI=1S/C15H30N2O/c1-16-12-15(8-10-18-11-9-15)13-17(2)14-6-4-3-5-7-14/h14,16H,3-13H2,1-2H3
InChIKeyORRCMYJFAVMHQF-UHFFFAOYSA-N
MW254.42 g/mol
LogP2.27
Rot. Bonds5

About N-methyl-N-[[4-(methylaminomethyl)oxan-4-yl]methyl]cyclohexanamine

N-methyl-N-[[4-(methylaminomethyl)oxan-4-yl]methyl]cyclohexanamine (PubChem CID 55066283) has the molecular formula C15H30N2O and a molecular weight of 254.42 g/mol. Its IUPAC name is N-methyl-N-[[4-(methylaminomethyl)oxan-4-yl]methyl]cyclohexanamine.

Molecular Properties

Compound NameN-methyl-N-[[4-(methylaminomethyl)oxan-4-yl]methyl]cyclohexanamine
PubChem CID55066283
Molecular FormulaC15H30N2O
Molecular Weight254.42 g/mol
Exact Mass254.24
IUPAC NameN-methyl-N-[[4-(methylaminomethyl)oxan-4-yl]methyl]cyclohexanamine
SMILESCNCC1(CN(C)C2CCCCC2)CCOCC1
InChIInChI=1S/C15H30N2O/c1-16-12-15(8-10-18-11-9-15)13-17(2)14-6-4-3-5-7-14/h14,16H,3-13H2,1-2H3
InChIKeyORRCMYJFAVMHQF-UHFFFAOYSA-N
XLogP2.27
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.42
LogP ≤ 52.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-methyl-N-[[4-(methylaminomethyl)oxan-4-yl]methyl]cyclohexanamine 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 N-methyl-N-[[4-(methylaminomethyl)oxan-4-yl]methyl]cyclohexanamine?
The IUPAC name of N-methyl-N-[[4-(methylaminomethyl)oxan-4-yl]methyl]cyclohexanamine (CID 55066283) is N-methyl-N-[[4-(methylaminomethyl)oxan-4-yl]methyl]cyclohexanamine.
What is the SMILES notation for N-methyl-N-[[4-(methylaminomethyl)oxan-4-yl]methyl]cyclohexanamine?
The canonical SMILES for N-methyl-N-[[4-(methylaminomethyl)oxan-4-yl]methyl]cyclohexanamine is CNCC1(CN(C)C2CCCCC2)CCOCC1.
What is the InChIKey of N-methyl-N-[[4-(methylaminomethyl)oxan-4-yl]methyl]cyclohexanamine?
The InChIKey is ORRCMYJFAVMHQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2O/c1-16-12-15(8-10-18-11-9-15)13-17(2)14-6-4-3-5-7-14/h14,16H,3-13H2,1-2H3.
What are the key properties of N-methyl-N-[[4-(methylaminomethyl)oxan-4-yl]methyl]cyclohexanamine?
N-methyl-N-[[4-(methylaminomethyl)oxan-4-yl]methyl]cyclohexanamine has a molecular weight of 254.42 g/mol, XLogP of 2.27, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[[4-(methylaminomethyl)oxan-4-yl]methyl]cyclohexanamine is sourced from PubChem (CID 55066283), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).