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

C15H32N2O2 — CID 64681197

IUPAC1-[2-[2-methoxyethyl(3-methoxypropyl)amino]ethyl]cyclohexan-1-amine
SMILESCOCCCN(CCOC)CCC1(N)CCCCC1
InChIInChI=1S/C15H32N2O2/c1-18-13-6-10-17(12-14-19-2)11-9-15(16)7-4-3-5-8-15/h3-14,16H2,1-2H3
InChIKeyMBZKNFHMTFGHDT-UHFFFAOYSA-N
MW272.43 g/mol
LogP2.02
Rot. Bonds10

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

1-[2-[2-methoxyethyl(3-methoxypropyl)amino]ethyl]cyclohexan-1-amine (PubChem CID 64681197) has the molecular formula C15H32N2O2 and a molecular weight of 272.43 g/mol. Its IUPAC name is 1-[2-[2-methoxyethyl(3-methoxypropyl)amino]ethyl]cyclohexan-1-amine.

Molecular Properties

Compound Name1-[2-[2-methoxyethyl(3-methoxypropyl)amino]ethyl]cyclohexan-1-amine
PubChem CID64681197
Molecular FormulaC15H32N2O2
Molecular Weight272.43 g/mol
Exact Mass272.25
IUPAC Name1-[2-[2-methoxyethyl(3-methoxypropyl)amino]ethyl]cyclohexan-1-amine
SMILESCOCCCN(CCOC)CCC1(N)CCCCC1
InChIInChI=1S/C15H32N2O2/c1-18-13-6-10-17(12-14-19-2)11-9-15(16)7-4-3-5-8-15/h3-14,16H2,1-2H3
InChIKeyMBZKNFHMTFGHDT-UHFFFAOYSA-N
XLogP2.02
TPSA47.72 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.43
LogP ≤ 52.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-[2-[2-methoxyethyl(3-methoxypropyl)amino]ethyl]cyclohexan-1-amine?
The IUPAC name of 1-[2-[2-methoxyethyl(3-methoxypropyl)amino]ethyl]cyclohexan-1-amine (CID 64681197) is 1-[2-[2-methoxyethyl(3-methoxypropyl)amino]ethyl]cyclohexan-1-amine.
What is the SMILES notation for 1-[2-[2-methoxyethyl(3-methoxypropyl)amino]ethyl]cyclohexan-1-amine?
The canonical SMILES for 1-[2-[2-methoxyethyl(3-methoxypropyl)amino]ethyl]cyclohexan-1-amine is COCCCN(CCOC)CCC1(N)CCCCC1.
What is the InChIKey of 1-[2-[2-methoxyethyl(3-methoxypropyl)amino]ethyl]cyclohexan-1-amine?
The InChIKey is MBZKNFHMTFGHDT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H32N2O2/c1-18-13-6-10-17(12-14-19-2)11-9-15(16)7-4-3-5-8-15/h3-14,16H2,1-2H3.
What are the key properties of 1-[2-[2-methoxyethyl(3-methoxypropyl)amino]ethyl]cyclohexan-1-amine?
1-[2-[2-methoxyethyl(3-methoxypropyl)amino]ethyl]cyclohexan-1-amine has a molecular weight of 272.43 g/mol, XLogP of 2.02, 10 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-[2-methoxyethyl(3-methoxypropyl)amino]ethyl]cyclohexan-1-amine is sourced from PubChem (CID 64681197), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).