N-(2-methylpropyl)-3-oxo-2-propan-2-yl-2-azaspiro[3.4]octane-1-carboxamide

C15H26N2O2 — CID 110204006

IUPACN-(2-methylpropyl)-3-oxo-2-propan-2-yl-2-azaspiro[3.4]octane-1-carboxamide
SMILESCC(C)CNC(=O)C1N(C(C)C)C(=O)C12CCCC2
InChIInChI=1S/C15H26N2O2/c1-10(2)9-16-13(18)12-15(7-5-6-8-15)14(19)17(12)11(3)4/h10-12H,5-9H2,1-4H3,(H,16,18)
InChIKeyHWUSTAMWTOQETO-UHFFFAOYSA-N
MW266.38 g/mol
LogP1.94
Rot. Bonds4

About N-(2-methylpropyl)-3-oxo-2-propan-2-yl-2-azaspiro[3.4]octane-1-carboxamide

N-(2-methylpropyl)-3-oxo-2-propan-2-yl-2-azaspiro[3.4]octane-1-carboxamide (PubChem CID 110204006) has the molecular formula C15H26N2O2 and a molecular weight of 266.38 g/mol. Its IUPAC name is N-(2-methylpropyl)-3-oxo-2-propan-2-yl-2-azaspiro[3.4]octane-1-carboxamide.

Molecular Properties

Compound NameN-(2-methylpropyl)-3-oxo-2-propan-2-yl-2-azaspiro[3.4]octane-1-carboxamide
PubChem CID110204006
Molecular FormulaC15H26N2O2
Molecular Weight266.38 g/mol
Exact Mass266.20
IUPAC NameN-(2-methylpropyl)-3-oxo-2-propan-2-yl-2-azaspiro[3.4]octane-1-carboxamide
SMILESCC(C)CNC(=O)C1N(C(C)C)C(=O)C12CCCC2
InChIInChI=1S/C15H26N2O2/c1-10(2)9-16-13(18)12-15(7-5-6-8-15)14(19)17(12)11(3)4/h10-12H,5-9H2,1-4H3,(H,16,18)
InChIKeyHWUSTAMWTOQETO-UHFFFAOYSA-N
XLogP1.94
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.38
LogP ≤ 51.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(2-methylpropyl)-3-oxo-2-propan-2-yl-2-azaspiro[3.4]octane-1-carboxamide?
The IUPAC name of N-(2-methylpropyl)-3-oxo-2-propan-2-yl-2-azaspiro[3.4]octane-1-carboxamide (CID 110204006) is N-(2-methylpropyl)-3-oxo-2-propan-2-yl-2-azaspiro[3.4]octane-1-carboxamide.
What is the SMILES notation for N-(2-methylpropyl)-3-oxo-2-propan-2-yl-2-azaspiro[3.4]octane-1-carboxamide?
The canonical SMILES for N-(2-methylpropyl)-3-oxo-2-propan-2-yl-2-azaspiro[3.4]octane-1-carboxamide is CC(C)CNC(=O)C1N(C(C)C)C(=O)C12CCCC2.
What is the InChIKey of N-(2-methylpropyl)-3-oxo-2-propan-2-yl-2-azaspiro[3.4]octane-1-carboxamide?
The InChIKey is HWUSTAMWTOQETO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2O2/c1-10(2)9-16-13(18)12-15(7-5-6-8-15)14(19)17(12)11(3)4/h10-12H,5-9H2,1-4H3,(H,16,18).
What are the key properties of N-(2-methylpropyl)-3-oxo-2-propan-2-yl-2-azaspiro[3.4]octane-1-carboxamide?
N-(2-methylpropyl)-3-oxo-2-propan-2-yl-2-azaspiro[3.4]octane-1-carboxamide has a molecular weight of 266.38 g/mol, XLogP of 1.94, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methylpropyl)-3-oxo-2-propan-2-yl-2-azaspiro[3.4]octane-1-carboxamide is sourced from PubChem (CID 110204006), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).