2-[2-methyl-3-(propylamino)oxolan-3-yl]ethanol

C10H21NO2 — CID 82719476

IUPAC2-[2-methyl-3-(propylamino)oxolan-3-yl]ethanol
SMILESCCCNC1(CCO)CCOC1C
InChIInChI=1S/C10H21NO2/c1-3-6-11-10(4-7-12)5-8-13-9(10)2/h9,11-12H,3-8H2,1-2H3
InChIKeyNGSYRFDQIRKPJD-UHFFFAOYSA-N
MW187.28 g/mol
LogP0.92
Rot. Bonds5

About 2-[2-methyl-3-(propylamino)oxolan-3-yl]ethanol

2-[2-methyl-3-(propylamino)oxolan-3-yl]ethanol (PubChem CID 82719476) has the molecular formula C10H21NO2 and a molecular weight of 187.28 g/mol. Its IUPAC name is 2-[2-methyl-3-(propylamino)oxolan-3-yl]ethanol.

Molecular Properties

Compound Name2-[2-methyl-3-(propylamino)oxolan-3-yl]ethanol
PubChem CID82719476
Molecular FormulaC10H21NO2
Molecular Weight187.28 g/mol
Exact Mass187.16
IUPAC Name2-[2-methyl-3-(propylamino)oxolan-3-yl]ethanol
SMILESCCCNC1(CCO)CCOC1C
InChIInChI=1S/C10H21NO2/c1-3-6-11-10(4-7-12)5-8-13-9(10)2/h9,11-12H,3-8H2,1-2H3
InChIKeyNGSYRFDQIRKPJD-UHFFFAOYSA-N
XLogP0.92
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.28
LogP ≤ 50.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[2-methyl-3-(propylamino)oxolan-3-yl]ethanol?
The IUPAC name of 2-[2-methyl-3-(propylamino)oxolan-3-yl]ethanol (CID 82719476) is 2-[2-methyl-3-(propylamino)oxolan-3-yl]ethanol.
What is the SMILES notation for 2-[2-methyl-3-(propylamino)oxolan-3-yl]ethanol?
The canonical SMILES for 2-[2-methyl-3-(propylamino)oxolan-3-yl]ethanol is CCCNC1(CCO)CCOC1C.
What is the InChIKey of 2-[2-methyl-3-(propylamino)oxolan-3-yl]ethanol?
The InChIKey is NGSYRFDQIRKPJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NO2/c1-3-6-11-10(4-7-12)5-8-13-9(10)2/h9,11-12H,3-8H2,1-2H3.
What are the key properties of 2-[2-methyl-3-(propylamino)oxolan-3-yl]ethanol?
2-[2-methyl-3-(propylamino)oxolan-3-yl]ethanol has a molecular weight of 187.28 g/mol, XLogP of 0.92, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-methyl-3-(propylamino)oxolan-3-yl]ethanol is sourced from PubChem (CID 82719476), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).