N,6-dimethyl-N-[3-methyl-1-(methylamino)-1-oxobutan-2-yl]-2,6-diazaspiro[3.3]heptane-2-carboxamide

C14H26N4O2 — CID 178020001

IUPACN,6-dimethyl-N-[3-methyl-1-(methylamino)-1-oxobutan-2-yl]-2,6-diazaspiro[3.3]heptane-2-carboxamide
SMILESCNC(=O)C(C(C)C)N(C)C(=O)N1CC2(CN(C)C2)C1
InChIInChI=1S/C14H26N4O2/c1-10(2)11(12(19)15-3)17(5)13(20)18-8-14(9-18)6-16(4)7-14/h10-11H,6-9H2,1-5H3,(H,15,19)
InChIKeySSEJBLZTAIORIL-UHFFFAOYSA-N
MW282.39 g/mol
LogP0.06
Rot. Bonds3

About N,6-dimethyl-N-[3-methyl-1-(methylamino)-1-oxobutan-2-yl]-2,6-diazaspiro[3.3]heptane-2-carboxamide

N,6-dimethyl-N-[3-methyl-1-(methylamino)-1-oxobutan-2-yl]-2,6-diazaspiro[3.3]heptane-2-carboxamide (PubChem CID 178020001) has the molecular formula C14H26N4O2 and a molecular weight of 282.39 g/mol. Its IUPAC name is N,6-dimethyl-N-[3-methyl-1-(methylamino)-1-oxobutan-2-yl]-2,6-diazaspiro[3.3]heptane-2-carboxamide.

Molecular Properties

Compound NameN,6-dimethyl-N-[3-methyl-1-(methylamino)-1-oxobutan-2-yl]-2,6-diazaspiro[3.3]heptane-2-carboxamide
PubChem CID178020001
Molecular FormulaC14H26N4O2
Molecular Weight282.39 g/mol
Exact Mass282.21
IUPAC NameN,6-dimethyl-N-[3-methyl-1-(methylamino)-1-oxobutan-2-yl]-2,6-diazaspiro[3.3]heptane-2-carboxamide
SMILESCNC(=O)C(C(C)C)N(C)C(=O)N1CC2(CN(C)C2)C1
InChIInChI=1S/C14H26N4O2/c1-10(2)11(12(19)15-3)17(5)13(20)18-8-14(9-18)6-16(4)7-14/h10-11H,6-9H2,1-5H3,(H,15,19)
InChIKeySSEJBLZTAIORIL-UHFFFAOYSA-N
XLogP0.06
TPSA55.89 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.39
LogP ≤ 50.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N,6-dimethyl-N-[3-methyl-1-(methylamino)-1-oxobutan-2-yl]-2,6-diazaspiro[3.3]heptane-2-carboxamide?
The IUPAC name of N,6-dimethyl-N-[3-methyl-1-(methylamino)-1-oxobutan-2-yl]-2,6-diazaspiro[3.3]heptane-2-carboxamide (CID 178020001) is N,6-dimethyl-N-[3-methyl-1-(methylamino)-1-oxobutan-2-yl]-2,6-diazaspiro[3.3]heptane-2-carboxamide.
What is the SMILES notation for N,6-dimethyl-N-[3-methyl-1-(methylamino)-1-oxobutan-2-yl]-2,6-diazaspiro[3.3]heptane-2-carboxamide?
The canonical SMILES for N,6-dimethyl-N-[3-methyl-1-(methylamino)-1-oxobutan-2-yl]-2,6-diazaspiro[3.3]heptane-2-carboxamide is CNC(=O)C(C(C)C)N(C)C(=O)N1CC2(CN(C)C2)C1.
What is the InChIKey of N,6-dimethyl-N-[3-methyl-1-(methylamino)-1-oxobutan-2-yl]-2,6-diazaspiro[3.3]heptane-2-carboxamide?
The InChIKey is SSEJBLZTAIORIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N4O2/c1-10(2)11(12(19)15-3)17(5)13(20)18-8-14(9-18)6-16(4)7-14/h10-11H,6-9H2,1-5H3,(H,15,19).
What are the key properties of N,6-dimethyl-N-[3-methyl-1-(methylamino)-1-oxobutan-2-yl]-2,6-diazaspiro[3.3]heptane-2-carboxamide?
N,6-dimethyl-N-[3-methyl-1-(methylamino)-1-oxobutan-2-yl]-2,6-diazaspiro[3.3]heptane-2-carboxamide has a molecular weight of 282.39 g/mol, XLogP of 0.06, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,6-dimethyl-N-[3-methyl-1-(methylamino)-1-oxobutan-2-yl]-2,6-diazaspiro[3.3]heptane-2-carboxamide is sourced from PubChem (CID 178020001), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).