6-ethyl-N,N-dimethyl-2-azaspiro[3.4]octane-2-carboxamide

C12H22N2O — CID 118518392

IUPAC6-ethyl-N,N-dimethyl-2-azaspiro[3.4]octane-2-carboxamide
SMILESCCC1CCC2(C1)CN(C(=O)N(C)C)C2
InChIInChI=1S/C12H22N2O/c1-4-10-5-6-12(7-10)8-14(9-12)11(15)13(2)3/h10H,4-9H2,1-3H3
InChIKeyXOYWQODNAQATHY-UHFFFAOYSA-N
MW210.32 g/mol
LogP2.18
Rot. Bonds1

About 6-ethyl-N,N-dimethyl-2-azaspiro[3.4]octane-2-carboxamide

6-ethyl-N,N-dimethyl-2-azaspiro[3.4]octane-2-carboxamide (PubChem CID 118518392) has the molecular formula C12H22N2O and a molecular weight of 210.32 g/mol. Its IUPAC name is 6-ethyl-N,N-dimethyl-2-azaspiro[3.4]octane-2-carboxamide.

Molecular Properties

Compound Name6-ethyl-N,N-dimethyl-2-azaspiro[3.4]octane-2-carboxamide
PubChem CID118518392
Molecular FormulaC12H22N2O
Molecular Weight210.32 g/mol
Exact Mass210.17
IUPAC Name6-ethyl-N,N-dimethyl-2-azaspiro[3.4]octane-2-carboxamide
SMILESCCC1CCC2(C1)CN(C(=O)N(C)C)C2
InChIInChI=1S/C12H22N2O/c1-4-10-5-6-12(7-10)8-14(9-12)11(15)13(2)3/h10H,4-9H2,1-3H3
InChIKeyXOYWQODNAQATHY-UHFFFAOYSA-N
XLogP2.18
TPSA23.55 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.32
LogP ≤ 52.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 6-ethyl-N,N-dimethyl-2-azaspiro[3.4]octane-2-carboxamide?
The IUPAC name of 6-ethyl-N,N-dimethyl-2-azaspiro[3.4]octane-2-carboxamide (CID 118518392) is 6-ethyl-N,N-dimethyl-2-azaspiro[3.4]octane-2-carboxamide.
What is the SMILES notation for 6-ethyl-N,N-dimethyl-2-azaspiro[3.4]octane-2-carboxamide?
The canonical SMILES for 6-ethyl-N,N-dimethyl-2-azaspiro[3.4]octane-2-carboxamide is CCC1CCC2(C1)CN(C(=O)N(C)C)C2.
What is the InChIKey of 6-ethyl-N,N-dimethyl-2-azaspiro[3.4]octane-2-carboxamide?
The InChIKey is XOYWQODNAQATHY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N2O/c1-4-10-5-6-12(7-10)8-14(9-12)11(15)13(2)3/h10H,4-9H2,1-3H3.
What are the key properties of 6-ethyl-N,N-dimethyl-2-azaspiro[3.4]octane-2-carboxamide?
6-ethyl-N,N-dimethyl-2-azaspiro[3.4]octane-2-carboxamide has a molecular weight of 210.32 g/mol, XLogP of 2.18, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethyl-N,N-dimethyl-2-azaspiro[3.4]octane-2-carboxamide is sourced from PubChem (CID 118518392), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).