1-(2-ethoxyethoxy)-3-[(2-ethylcyclohexyl)amino]propan-2-ol

C15H31NO3 — CID 61467310

IUPAC1-(2-ethoxyethoxy)-3-[(2-ethylcyclohexyl)amino]propan-2-ol
SMILESCCOCCOCC(O)CNC1CCCCC1CC
InChIInChI=1S/C15H31NO3/c1-3-13-7-5-6-8-15(13)16-11-14(17)12-19-10-9-18-4-2/h13-17H,3-12H2,1-2H3
InChIKeyGOAQOPDBLZOOJN-UHFFFAOYSA-N
MW273.42 g/mol
LogP1.96
Rot. Bonds10

About 1-(2-ethoxyethoxy)-3-[(2-ethylcyclohexyl)amino]propan-2-ol

1-(2-ethoxyethoxy)-3-[(2-ethylcyclohexyl)amino]propan-2-ol (PubChem CID 61467310) has the molecular formula C15H31NO3 and a molecular weight of 273.42 g/mol. Its IUPAC name is 1-(2-ethoxyethoxy)-3-[(2-ethylcyclohexyl)amino]propan-2-ol.

Molecular Properties

Compound Name1-(2-ethoxyethoxy)-3-[(2-ethylcyclohexyl)amino]propan-2-ol
PubChem CID61467310
Molecular FormulaC15H31NO3
Molecular Weight273.42 g/mol
Exact Mass273.23
IUPAC Name1-(2-ethoxyethoxy)-3-[(2-ethylcyclohexyl)amino]propan-2-ol
SMILESCCOCCOCC(O)CNC1CCCCC1CC
InChIInChI=1S/C15H31NO3/c1-3-13-7-5-6-8-15(13)16-11-14(17)12-19-10-9-18-4-2/h13-17H,3-12H2,1-2H3
InChIKeyGOAQOPDBLZOOJN-UHFFFAOYSA-N
XLogP1.96
TPSA50.72 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.42
LogP ≤ 51.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

1-(cyclopropylmethoxy)-3-[(2-ethylcyclohexyl)amino]propan-2-ol
CID 54955680
1-[(2-ethylcyclohexyl)amino]-3-(1-methoxypropan-2-yloxy)propan-2-ol
CID 106989604
1-ethoxy-3-[(2-methylcyclohexyl)amino]propan-2-ol
CID 63933567
1-[(2-ethylcyclopentyl)amino]pentan-2-ol
CID 115719434
1-[(2-methylcyclohexyl)amino]-3-octoxypropan-2-ol
CID 60632322
1-(cycloheptylamino)-3-ethoxypropan-2-ol
CID 63933573
1-[[(1S)-1-cycloheptylethyl]amino]-3-(2-ethoxyethoxy)propan-2-ol
CID 81393423
1-(2-ethoxyethoxy)-3-[(9-methyl-9-azabicyclo[3.3.1]nonan-3-yl)amino]propan-2-ol
CID 65472582
1-cyclopentyl-2-[(2-ethylcyclopentyl)amino]ethanol
CID 115890580
1-(2-butoxyethoxy)-3-(cyclopentylamino)propan-2-ol
CID 60635270
1-(cyclopropylamino)-3-ethoxypropan-2-ol
CID 43166145
1-(2-butoxyethoxy)-3-(cyclohexylamino)propan-2-ol
CID 60633253

Frequently Asked Questions

What is the IUPAC name of 1-(2-ethoxyethoxy)-3-[(2-ethylcyclohexyl)amino]propan-2-ol?
The IUPAC name of 1-(2-ethoxyethoxy)-3-[(2-ethylcyclohexyl)amino]propan-2-ol (CID 61467310) is 1-(2-ethoxyethoxy)-3-[(2-ethylcyclohexyl)amino]propan-2-ol.
What is the SMILES notation for 1-(2-ethoxyethoxy)-3-[(2-ethylcyclohexyl)amino]propan-2-ol?
The canonical SMILES for 1-(2-ethoxyethoxy)-3-[(2-ethylcyclohexyl)amino]propan-2-ol is CCOCCOCC(O)CNC1CCCCC1CC.
What is the InChIKey of 1-(2-ethoxyethoxy)-3-[(2-ethylcyclohexyl)amino]propan-2-ol?
The InChIKey is GOAQOPDBLZOOJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H31NO3/c1-3-13-7-5-6-8-15(13)16-11-14(17)12-19-10-9-18-4-2/h13-17H,3-12H2,1-2H3.
What are the key properties of 1-(2-ethoxyethoxy)-3-[(2-ethylcyclohexyl)amino]propan-2-ol?
1-(2-ethoxyethoxy)-3-[(2-ethylcyclohexyl)amino]propan-2-ol has a molecular weight of 273.42 g/mol, XLogP of 1.96, 10 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-ethoxyethoxy)-3-[(2-ethylcyclohexyl)amino]propan-2-ol is sourced from PubChem (CID 61467310), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).