3-oxo-2-propan-2-yl-N-propyl-2-azaspiro[3.4]octane-1-carboxamide

C14H24N2O2 — CID 110204012

IUPAC3-oxo-2-propan-2-yl-N-propyl-2-azaspiro[3.4]octane-1-carboxamide
SMILESCCCNC(=O)C1N(C(C)C)C(=O)C12CCCC2
InChIInChI=1S/C14H24N2O2/c1-4-9-15-12(17)11-14(7-5-6-8-14)13(18)16(11)10(2)3/h10-11H,4-9H2,1-3H3,(H,15,17)
InChIKeyOIENDCJRKSIDTM-UHFFFAOYSA-N
MW252.36 g/mol
LogP1.69
Rot. Bonds4

About 3-oxo-2-propan-2-yl-N-propyl-2-azaspiro[3.4]octane-1-carboxamide

3-oxo-2-propan-2-yl-N-propyl-2-azaspiro[3.4]octane-1-carboxamide (PubChem CID 110204012) has the molecular formula C14H24N2O2 and a molecular weight of 252.36 g/mol. Its IUPAC name is 3-oxo-2-propan-2-yl-N-propyl-2-azaspiro[3.4]octane-1-carboxamide.

Molecular Properties

Compound Name3-oxo-2-propan-2-yl-N-propyl-2-azaspiro[3.4]octane-1-carboxamide
PubChem CID110204012
Molecular FormulaC14H24N2O2
Molecular Weight252.36 g/mol
Exact Mass252.18
IUPAC Name3-oxo-2-propan-2-yl-N-propyl-2-azaspiro[3.4]octane-1-carboxamide
SMILESCCCNC(=O)C1N(C(C)C)C(=O)C12CCCC2
InChIInChI=1S/C14H24N2O2/c1-4-9-15-12(17)11-14(7-5-6-8-14)13(18)16(11)10(2)3/h10-11H,4-9H2,1-3H3,(H,15,17)
InChIKeyOIENDCJRKSIDTM-UHFFFAOYSA-N
XLogP1.69
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.36
LogP ≤ 51.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-oxo-2-propan-2-yl-N-propyl-2-azaspiro[3.4]octane-1-carboxamide?
The IUPAC name of 3-oxo-2-propan-2-yl-N-propyl-2-azaspiro[3.4]octane-1-carboxamide (CID 110204012) is 3-oxo-2-propan-2-yl-N-propyl-2-azaspiro[3.4]octane-1-carboxamide.
What is the SMILES notation for 3-oxo-2-propan-2-yl-N-propyl-2-azaspiro[3.4]octane-1-carboxamide?
The canonical SMILES for 3-oxo-2-propan-2-yl-N-propyl-2-azaspiro[3.4]octane-1-carboxamide is CCCNC(=O)C1N(C(C)C)C(=O)C12CCCC2.
What is the InChIKey of 3-oxo-2-propan-2-yl-N-propyl-2-azaspiro[3.4]octane-1-carboxamide?
The InChIKey is OIENDCJRKSIDTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O2/c1-4-9-15-12(17)11-14(7-5-6-8-14)13(18)16(11)10(2)3/h10-11H,4-9H2,1-3H3,(H,15,17).
What are the key properties of 3-oxo-2-propan-2-yl-N-propyl-2-azaspiro[3.4]octane-1-carboxamide?
3-oxo-2-propan-2-yl-N-propyl-2-azaspiro[3.4]octane-1-carboxamide has a molecular weight of 252.36 g/mol, XLogP of 1.69, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-oxo-2-propan-2-yl-N-propyl-2-azaspiro[3.4]octane-1-carboxamide is sourced from PubChem (CID 110204012), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).