1-(diethylamino)ethanol;oxolane

C10H23NO2 — CID 175105244

IUPAC1-(diethylamino)ethanol;oxolane
SMILESC1CCOC1.CCN(CC)C(C)O
InChIInChI=1S/C6H15NO.C4H8O/c1-4-7(5-2)6(3)8;1-2-4-5-3-1/h6,8H,4-5H2,1-3H3;1-4H2
InChIKeyCOVVDMBMDZUXCM-UHFFFAOYSA-N
MW189.30 g/mol
LogP1.46
Rot. Bonds3

About 1-(diethylamino)ethanol;oxolane

1-(diethylamino)ethanol;oxolane (PubChem CID 175105244) has the molecular formula C10H23NO2 and a molecular weight of 189.30 g/mol. Its IUPAC name is 1-(diethylamino)ethanol;oxolane.

Molecular Properties

Compound Name1-(diethylamino)ethanol;oxolane
PubChem CID175105244
Molecular FormulaC10H23NO2
Molecular Weight189.30 g/mol
Exact Mass189.17
IUPAC Name1-(diethylamino)ethanol;oxolane
SMILESC1CCOC1.CCN(CC)C(C)O
InChIInChI=1S/C6H15NO.C4H8O/c1-4-7(5-2)6(3)8;1-2-4-5-3-1/h6,8H,4-5H2,1-3H3;1-4H2
InChIKeyCOVVDMBMDZUXCM-UHFFFAOYSA-N
XLogP1.46
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.30
LogP ≤ 51.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

oxolane;propan-2-ol
CID 22597222
N-ethyl-N-propan-2-ylpropan-2-amine;oxane
CID 68856314
1-(diethylamino)ethanol;sulfuric acid
CID 88696219
1-ethoxyethanol;oxolane
CID 174868802
2-methylpropane;oxolane
CID 70603205
ethanol;oxolane;hydrochloride
CID 23103637
ethanol;oxane
CID 68981478
oxolane;propan-2-ol;propan-2-one
CID 174956969
2-methylpropane;oxane
CID 91454058
2-chloropropane;oxolane
CID 159770837
ethane;2-methylpropane;oxane
CID 91157399
diethyl 2-methylpropanedioate;oxolane
CID 174718682

Frequently Asked Questions

What is the IUPAC name of 1-(diethylamino)ethanol;oxolane?
The IUPAC name of 1-(diethylamino)ethanol;oxolane (CID 175105244) is 1-(diethylamino)ethanol;oxolane.
What is the SMILES notation for 1-(diethylamino)ethanol;oxolane?
The canonical SMILES for 1-(diethylamino)ethanol;oxolane is C1CCOC1.CCN(CC)C(C)O.
What is the InChIKey of 1-(diethylamino)ethanol;oxolane?
The InChIKey is COVVDMBMDZUXCM-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H15NO.C4H8O/c1-4-7(5-2)6(3)8;1-2-4-5-3-1/h6,8H,4-5H2,1-3H3;1-4H2.
What are the key properties of 1-(diethylamino)ethanol;oxolane?
1-(diethylamino)ethanol;oxolane has a molecular weight of 189.30 g/mol, XLogP of 1.46, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(diethylamino)ethanol;oxolane is sourced from PubChem (CID 175105244), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).