N,N-diethylethanamine;oxolane

C10H23NO — CID 68616177

IUPACN,N-diethylethanamine;oxolane
SMILESC1CCOC1.CCN(CC)CC
InChIInChI=1S/C6H15N.C4H8O/c1-4-7(5-2)6-3;1-2-4-5-3-1/h4-6H2,1-3H3;1-4H2
InChIKeyVSPPONOIKZXUBJ-UHFFFAOYSA-N
MW173.30 g/mol
LogP2.14
Rot. Bonds3

About N,N-diethylethanamine;oxolane

N,N-diethylethanamine;oxolane (PubChem CID 68616177) has the molecular formula C10H23NO and a molecular weight of 173.30 g/mol. Its IUPAC name is N,N-diethylethanamine;oxolane.

Molecular Properties

Compound NameN,N-diethylethanamine;oxolane
PubChem CID68616177
Molecular FormulaC10H23NO
Molecular Weight173.30 g/mol
Exact Mass173.18
IUPAC NameN,N-diethylethanamine;oxolane
SMILESC1CCOC1.CCN(CC)CC
InChIInChI=1S/C6H15N.C4H8O/c1-4-7(5-2)6-3;1-2-4-5-3-1/h4-6H2,1-3H3;1-4H2
InChIKeyVSPPONOIKZXUBJ-UHFFFAOYSA-N
XLogP2.14
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.30
LogP ≤ 52.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N,N-diethylethanamine;oxolane?
The IUPAC name of N,N-diethylethanamine;oxolane (CID 68616177) is N,N-diethylethanamine;oxolane.
What is the SMILES notation for N,N-diethylethanamine;oxolane?
The canonical SMILES for N,N-diethylethanamine;oxolane is C1CCOC1.CCN(CC)CC.
What is the InChIKey of N,N-diethylethanamine;oxolane?
The InChIKey is VSPPONOIKZXUBJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H15N.C4H8O/c1-4-7(5-2)6-3;1-2-4-5-3-1/h4-6H2,1-3H3;1-4H2.
What are the key properties of N,N-diethylethanamine;oxolane?
N,N-diethylethanamine;oxolane has a molecular weight of 173.30 g/mol, XLogP of 2.14, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethylethanamine;oxolane is sourced from PubChem (CID 68616177), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).