2-N-cyclohexyl-3-ethoxy-2-N-ethyl-2-methylpropane-1,2-diamine

C14H30N2O — CID 113493169

IUPAC2-N-cyclohexyl-3-ethoxy-2-N-ethyl-2-methylpropane-1,2-diamine
SMILESCCOCC(C)(CN)N(CC)C1CCCCC1
InChIInChI=1S/C14H30N2O/c1-4-16(13-9-7-6-8-10-13)14(3,11-15)12-17-5-2/h13H,4-12,15H2,1-3H3
InChIKeyULFDESMLFSHXME-UHFFFAOYSA-N
MW242.41 g/mol
LogP2.39
Rot. Bonds7

About 2-N-cyclohexyl-3-ethoxy-2-N-ethyl-2-methylpropane-1,2-diamine

2-N-cyclohexyl-3-ethoxy-2-N-ethyl-2-methylpropane-1,2-diamine (PubChem CID 113493169) has the molecular formula C14H30N2O and a molecular weight of 242.41 g/mol. Its IUPAC name is 2-N-cyclohexyl-3-ethoxy-2-N-ethyl-2-methylpropane-1,2-diamine.

Molecular Properties

Compound Name2-N-cyclohexyl-3-ethoxy-2-N-ethyl-2-methylpropane-1,2-diamine
PubChem CID113493169
Molecular FormulaC14H30N2O
Molecular Weight242.41 g/mol
Exact Mass242.24
IUPAC Name2-N-cyclohexyl-3-ethoxy-2-N-ethyl-2-methylpropane-1,2-diamine
SMILESCCOCC(C)(CN)N(CC)C1CCCCC1
InChIInChI=1S/C14H30N2O/c1-4-16(13-9-7-6-8-10-13)14(3,11-15)12-17-5-2/h13H,4-12,15H2,1-3H3
InChIKeyULFDESMLFSHXME-UHFFFAOYSA-N
XLogP2.39
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.41
LogP ≤ 52.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-N-cyclopentyl-2-N-ethyl-3-methoxy-2-methylpropane-1,2-diamine
CID 62535108
2-N-cyclopropyl-2-N-ethyl-3-methoxy-2-methylpropane-1,2-diamine
CID 62537022
2-N-cyclohexyl-2-N-ethyl-2,5-dimethylhexane-1,2-diamine
CID 43409655
2-N-cyclopentyl-2-N-ethyl-2,5-dimethylhexane-1,2-diamine
CID 43540970
2-N-cyclopentyl-2-N-ethyl-2-methyl-3-phenylpropane-1,2-diamine
CID 55150298
2-N-cyclopentyl-2-cyclopropyl-2-N-ethylpropane-1,2-diamine
CID 43540936
2-N-cyclohexyl-2-N-ethyl-3-(3-fluorophenyl)-2-methylpropane-1,2-diamine
CID 114831000
[2-(ethoxymethoxy)cyclopentyl]methanamine
CID 106938405
2-N-cyclopropyl-3-methoxy-2-methyl-2-N-(2,2,2-trifluoroethyl)propane-1,2-diamine
CID 115002693
1-(1-amino-3-ethoxy-2-methylpropan-2-yl)-N,N-diethylpyrrolidin-3-amine
CID 113493213
2-N-cycloheptyl-2-N,2-dimethylnonane-1,2-diamine
CID 43613910
2-cyclohexyl-2-methylpropan-1-amine
CID 19776368

Frequently Asked Questions

What is the IUPAC name of 2-N-cyclohexyl-3-ethoxy-2-N-ethyl-2-methylpropane-1,2-diamine?
The IUPAC name of 2-N-cyclohexyl-3-ethoxy-2-N-ethyl-2-methylpropane-1,2-diamine (CID 113493169) is 2-N-cyclohexyl-3-ethoxy-2-N-ethyl-2-methylpropane-1,2-diamine.
What is the SMILES notation for 2-N-cyclohexyl-3-ethoxy-2-N-ethyl-2-methylpropane-1,2-diamine?
The canonical SMILES for 2-N-cyclohexyl-3-ethoxy-2-N-ethyl-2-methylpropane-1,2-diamine is CCOCC(C)(CN)N(CC)C1CCCCC1.
What is the InChIKey of 2-N-cyclohexyl-3-ethoxy-2-N-ethyl-2-methylpropane-1,2-diamine?
The InChIKey is ULFDESMLFSHXME-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H30N2O/c1-4-16(13-9-7-6-8-10-13)14(3,11-15)12-17-5-2/h13H,4-12,15H2,1-3H3.
What are the key properties of 2-N-cyclohexyl-3-ethoxy-2-N-ethyl-2-methylpropane-1,2-diamine?
2-N-cyclohexyl-3-ethoxy-2-N-ethyl-2-methylpropane-1,2-diamine has a molecular weight of 242.41 g/mol, XLogP of 2.39, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-cyclohexyl-3-ethoxy-2-N-ethyl-2-methylpropane-1,2-diamine is sourced from PubChem (CID 113493169), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).