2-cyclopropyl-3-(2-ethylcyclohexyl)oxy-2-(methylamino)propan-1-ol

C15H29NO2 — CID 64804840

IUPAC2-cyclopropyl-3-(2-ethylcyclohexyl)oxy-2-(methylamino)propan-1-ol
SMILESCCC1CCCCC1OCC(CO)(NC)C1CC1
InChIInChI=1S/C15H29NO2/c1-3-12-6-4-5-7-14(12)18-11-15(10-17,16-2)13-8-9-13/h12-14,16-17H,3-11H2,1-2H3
InChIKeyJQDWHVNGHHVXSV-UHFFFAOYSA-N
MW255.40 g/mol
LogP2.33
Rot. Bonds7

About 2-cyclopropyl-3-(2-ethylcyclohexyl)oxy-2-(methylamino)propan-1-ol

2-cyclopropyl-3-(2-ethylcyclohexyl)oxy-2-(methylamino)propan-1-ol (PubChem CID 64804840) has the molecular formula C15H29NO2 and a molecular weight of 255.40 g/mol. Its IUPAC name is 2-cyclopropyl-3-(2-ethylcyclohexyl)oxy-2-(methylamino)propan-1-ol.

Molecular Properties

Compound Name2-cyclopropyl-3-(2-ethylcyclohexyl)oxy-2-(methylamino)propan-1-ol
PubChem CID64804840
Molecular FormulaC15H29NO2
Molecular Weight255.40 g/mol
Exact Mass255.22
IUPAC Name2-cyclopropyl-3-(2-ethylcyclohexyl)oxy-2-(methylamino)propan-1-ol
SMILESCCC1CCCCC1OCC(CO)(NC)C1CC1
InChIInChI=1S/C15H29NO2/c1-3-12-6-4-5-7-14(12)18-11-15(10-17,16-2)13-8-9-13/h12-14,16-17H,3-11H2,1-2H3
InChIKeyJQDWHVNGHHVXSV-UHFFFAOYSA-N
XLogP2.33
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.40
LogP ≤ 52.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-cyclopropyl-3-(2-ethylcyclohexyl)oxy-2-(methylamino)propanenitrile
CID 63907964
2-cyclopropyl-2-(methylamino)-3-(2-methylpropoxy)propan-1-ol
CID 64802778
3-cyclobutyloxy-2-cyclopropyl-2-(ethylamino)propan-1-ol
CID 64808658
4-(2-ethylcyclohexyl)oxy-2-methyl-2-(propylamino)butan-1-ol
CID 64802334
2-cyclopropyl-3-(2-ethylpiperidin-1-yl)-2-(methylamino)propan-1-ol
CID 64797230
1-cyclopentyl-2-(2-ethylcyclohexyl)oxyethanone
CID 104751673
1-ethyl-2-hydroperoxycyclohexane
CID 175085860
3-(2-ethylcyclohexyl)oxy-2,2-dimethylpropane-1-sulfonamide
CID 64999379
2-cyclopropyl-3-(1-methoxypropan-2-yloxy)-2-(methylamino)propan-1-ol
CID 64811394
3-(cyclopentylmethylsulfanyl)-2-cyclopropyl-2-(methylamino)propan-1-ol
CID 64805519
2-[2-(2-ethylcyclohexyl)oxyethyl]cyclopentan-1-ol
CID 79563747
1-(cyclohexylmethylamino)-3-(2-ethylcyclohexyl)oxypropan-2-ol
CID 60633455

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-3-(2-ethylcyclohexyl)oxy-2-(methylamino)propan-1-ol?
The IUPAC name of 2-cyclopropyl-3-(2-ethylcyclohexyl)oxy-2-(methylamino)propan-1-ol (CID 64804840) is 2-cyclopropyl-3-(2-ethylcyclohexyl)oxy-2-(methylamino)propan-1-ol.
What is the SMILES notation for 2-cyclopropyl-3-(2-ethylcyclohexyl)oxy-2-(methylamino)propan-1-ol?
The canonical SMILES for 2-cyclopropyl-3-(2-ethylcyclohexyl)oxy-2-(methylamino)propan-1-ol is CCC1CCCCC1OCC(CO)(NC)C1CC1.
What is the InChIKey of 2-cyclopropyl-3-(2-ethylcyclohexyl)oxy-2-(methylamino)propan-1-ol?
The InChIKey is JQDWHVNGHHVXSV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29NO2/c1-3-12-6-4-5-7-14(12)18-11-15(10-17,16-2)13-8-9-13/h12-14,16-17H,3-11H2,1-2H3.
What are the key properties of 2-cyclopropyl-3-(2-ethylcyclohexyl)oxy-2-(methylamino)propan-1-ol?
2-cyclopropyl-3-(2-ethylcyclohexyl)oxy-2-(methylamino)propan-1-ol has a molecular weight of 255.40 g/mol, XLogP of 2.33, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-3-(2-ethylcyclohexyl)oxy-2-(methylamino)propan-1-ol is sourced from PubChem (CID 64804840), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).