2-[4,4-dimethyl-3-(methylamino)oxolan-3-yl]ethanol

C9H19NO2 — CID 131186007

IUPAC2-[4,4-dimethyl-3-(methylamino)oxolan-3-yl]ethanol
SMILESCNC1(CCO)COCC1(C)C
InChIInChI=1S/C9H19NO2/c1-8(2)6-12-7-9(8,10-3)4-5-11/h10-11H,4-7H2,1-3H3
InChIKeyYUNNYYXMRKVTJD-UHFFFAOYSA-N
MW173.26 g/mol
LogP0.38
Rot. Bonds3

About 2-[4,4-dimethyl-3-(methylamino)oxolan-3-yl]ethanol

2-[4,4-dimethyl-3-(methylamino)oxolan-3-yl]ethanol (PubChem CID 131186007) has the molecular formula C9H19NO2 and a molecular weight of 173.26 g/mol. Its IUPAC name is 2-[4,4-dimethyl-3-(methylamino)oxolan-3-yl]ethanol.

Molecular Properties

Compound Name2-[4,4-dimethyl-3-(methylamino)oxolan-3-yl]ethanol
PubChem CID131186007
Molecular FormulaC9H19NO2
Molecular Weight173.26 g/mol
Exact Mass173.14
IUPAC Name2-[4,4-dimethyl-3-(methylamino)oxolan-3-yl]ethanol
SMILESCNC1(CCO)COCC1(C)C
InChIInChI=1S/C9H19NO2/c1-8(2)6-12-7-9(8,10-3)4-5-11/h10-11H,4-7H2,1-3H3
InChIKeyYUNNYYXMRKVTJD-UHFFFAOYSA-N
XLogP0.38
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.26
LogP ≤ 50.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-(Methoxymethyl)-3-(methylamino)pentane-1,5-diol
CID 117831273
4-Methoxy-2-(2-methoxyethyl)-2-(methylamino)butan-1-ol
CID 117831383
3-tert-butyl-N-methyloxolan-3-amine
CID 167376204
2-[3-(Ethylamino)oxolan-3-yl]ethanol
CID 65234408
2-[3-(Propylamino)oxolan-3-yl]ethanol
CID 65234619
2-[3-(Methylamino)tetrahydrofuran-3-yl]ethanol
CID 65235040
[2,2,5,5-Tetramethyl-3-(methylamino)oxolan-3-yl]methanol
CID 79933136
2-[2,2,5,5-Tetramethyl-3-(methylamino)oxolan-3-yl]ethanol
CID 79934408
3-(Methoxymethyl)-4-methyl-3-(methylamino)pentan-1-ol
CID 80411776
2-[2-Methyl-3-(methylamino)oxolan-3-yl]ethanol
CID 82717714
2-[3-(Ethylamino)-2-methyloxolan-3-yl]ethanol
CID 82717715
2-[2-Methyl-3-(propylamino)oxolan-3-yl]ethanol
CID 82719476

Frequently Asked Questions

What is the IUPAC name of 2-[4,4-dimethyl-3-(methylamino)oxolan-3-yl]ethanol?
The IUPAC name of 2-[4,4-dimethyl-3-(methylamino)oxolan-3-yl]ethanol (CID 131186007) is 2-[4,4-dimethyl-3-(methylamino)oxolan-3-yl]ethanol.
What is the SMILES notation for 2-[4,4-dimethyl-3-(methylamino)oxolan-3-yl]ethanol?
The canonical SMILES for 2-[4,4-dimethyl-3-(methylamino)oxolan-3-yl]ethanol is CNC1(CCO)COCC1(C)C.
What is the InChIKey of 2-[4,4-dimethyl-3-(methylamino)oxolan-3-yl]ethanol?
The InChIKey is YUNNYYXMRKVTJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19NO2/c1-8(2)6-12-7-9(8,10-3)4-5-11/h10-11H,4-7H2,1-3H3.
What are the key properties of 2-[4,4-dimethyl-3-(methylamino)oxolan-3-yl]ethanol?
2-[4,4-dimethyl-3-(methylamino)oxolan-3-yl]ethanol has a molecular weight of 173.26 g/mol, XLogP of 0.38, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4,4-dimethyl-3-(methylamino)oxolan-3-yl]ethanol is sourced from PubChem (CID 131186007), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).