N-ethyl-2-[[2-methoxyethyl(3-methoxypropyl)amino]methyl]cyclohexan-1-amine

C16H34N2O2 — CID 62614429

IUPACN-ethyl-2-[[2-methoxyethyl(3-methoxypropyl)amino]methyl]cyclohexan-1-amine
SMILESCCNC1CCCCC1CN(CCCOC)CCOC
InChIInChI=1S/C16H34N2O2/c1-4-17-16-9-6-5-8-15(16)14-18(11-13-20-3)10-7-12-19-2/h15-17H,4-14H2,1-3H3
InChIKeyJSDLEUMBQABHDQ-UHFFFAOYSA-N
MW286.46 g/mol
LogP2.14
Rot. Bonds11

About N-ethyl-2-[[2-methoxyethyl(3-methoxypropyl)amino]methyl]cyclohexan-1-amine

N-ethyl-2-[[2-methoxyethyl(3-methoxypropyl)amino]methyl]cyclohexan-1-amine (PubChem CID 62614429) has the molecular formula C16H34N2O2 and a molecular weight of 286.46 g/mol. Its IUPAC name is N-ethyl-2-[[2-methoxyethyl(3-methoxypropyl)amino]methyl]cyclohexan-1-amine.

Molecular Properties

Compound NameN-ethyl-2-[[2-methoxyethyl(3-methoxypropyl)amino]methyl]cyclohexan-1-amine
PubChem CID62614429
Molecular FormulaC16H34N2O2
Molecular Weight286.46 g/mol
Exact Mass286.26
IUPAC NameN-ethyl-2-[[2-methoxyethyl(3-methoxypropyl)amino]methyl]cyclohexan-1-amine
SMILESCCNC1CCCCC1CN(CCCOC)CCOC
InChIInChI=1S/C16H34N2O2/c1-4-17-16-9-6-5-8-15(16)14-18(11-13-20-3)10-7-12-19-2/h15-17H,4-14H2,1-3H3
InChIKeyJSDLEUMBQABHDQ-UHFFFAOYSA-N
XLogP2.14
TPSA33.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds11
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.46
LogP ≤ 52.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze N-ethyl-2-[[2-methoxyethyl(3-methoxypropyl)amino]methyl]cyclohexan-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 N-ethyl-2-[[2-methoxyethyl(3-methoxypropyl)amino]methyl]cyclohexan-1-amine?
The IUPAC name of N-ethyl-2-[[2-methoxyethyl(3-methoxypropyl)amino]methyl]cyclohexan-1-amine (CID 62614429) is N-ethyl-2-[[2-methoxyethyl(3-methoxypropyl)amino]methyl]cyclohexan-1-amine.
What is the SMILES notation for N-ethyl-2-[[2-methoxyethyl(3-methoxypropyl)amino]methyl]cyclohexan-1-amine?
The canonical SMILES for N-ethyl-2-[[2-methoxyethyl(3-methoxypropyl)amino]methyl]cyclohexan-1-amine is CCNC1CCCCC1CN(CCCOC)CCOC.
What is the InChIKey of N-ethyl-2-[[2-methoxyethyl(3-methoxypropyl)amino]methyl]cyclohexan-1-amine?
The InChIKey is JSDLEUMBQABHDQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H34N2O2/c1-4-17-16-9-6-5-8-15(16)14-18(11-13-20-3)10-7-12-19-2/h15-17H,4-14H2,1-3H3.
What are the key properties of N-ethyl-2-[[2-methoxyethyl(3-methoxypropyl)amino]methyl]cyclohexan-1-amine?
N-ethyl-2-[[2-methoxyethyl(3-methoxypropyl)amino]methyl]cyclohexan-1-amine has a molecular weight of 286.46 g/mol, XLogP of 2.14, 11 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-[[2-methoxyethyl(3-methoxypropyl)amino]methyl]cyclohexan-1-amine is sourced from PubChem (CID 62614429), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).