ethane;6-methyl-2-azaspiro[3.4]octane-2-carboxamide;N,N,6-trimethyl-2-azaspiro[3.4]octane-2-carboxamide

C28H60N4O2 — CID 144515769

IUPACethane;6-methyl-2-azaspiro[3.4]octane-2-carboxamide;N,N,6-trimethyl-2-azaspiro[3.4]octane-2-carboxamide
SMILESCC.CC.CC.CC.CC1CCC2(C1)CN(C(=O)N(C)C)C2.CC1CCC2(C1)CN(C(N)=O)C2
InChIInChI=1S/C11H20N2O.C9H16N2O.4C2H6/c1-9-4-5-11(6-9)7-13(8-11)10(14)12(2)3;1-7-2-3-9(4-7)5-11(6-9)8(10)12;4*1-2/h9H,4-8H2,1-3H3;7H,2-6H2,1H3,(H2,10,12);4*1-2H3
InChIKeyWDCOPVHPDLTRPF-UHFFFAOYSA-N
MW484.81 g/mol
LogP7.08
Rot. Bonds

About ethane;6-methyl-2-azaspiro[3.4]octane-2-carboxamide;N,N,6-trimethyl-2-azaspiro[3.4]octane-2-carboxamide

ethane;6-methyl-2-azaspiro[3.4]octane-2-carboxamide;N,N,6-trimethyl-2-azaspiro[3.4]octane-2-carboxamide (PubChem CID 144515769) has the molecular formula C28H60N4O2 and a molecular weight of 484.81 g/mol. Its IUPAC name is ethane;6-methyl-2-azaspiro[3.4]octane-2-carboxamide;N,N,6-trimethyl-2-azaspiro[3.4]octane-2-carboxamide.

Molecular Properties

Compound Nameethane;6-methyl-2-azaspiro[3.4]octane-2-carboxamide;N,N,6-trimethyl-2-azaspiro[3.4]octane-2-carboxamide
PubChem CID144515769
Molecular FormulaC28H60N4O2
Molecular Weight484.81 g/mol
Exact Mass484.47
IUPAC Nameethane;6-methyl-2-azaspiro[3.4]octane-2-carboxamide;N,N,6-trimethyl-2-azaspiro[3.4]octane-2-carboxamide
SMILESCC.CC.CC.CC.CC1CCC2(C1)CN(C(=O)N(C)C)C2.CC1CCC2(C1)CN(C(N)=O)C2
InChIInChI=1S/C11H20N2O.C9H16N2O.4C2H6/c1-9-4-5-11(6-9)7-13(8-11)10(14)12(2)3;1-7-2-3-9(4-7)5-11(6-9)8(10)12;4*1-2/h9H,4-8H2,1-3H3;7H,2-6H2,1H3,(H2,10,12);4*1-2H3
InChIKeyWDCOPVHPDLTRPF-UHFFFAOYSA-N
XLogP7.08
TPSA69.88 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms34
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500484.81
LogP ≤ 57.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze ethane;6-methyl-2-azaspiro[3.4]octane-2-carboxamide;N,N,6-trimethyl-2-azaspiro[3.4]octane-2-carboxamide with MolForge

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Related Compounds

2-(dimethylamino)-1-(6-methyl-2-azaspiro[3.4]octan-2-yl)ethanone
CID 90369802
butane;6-methyl-2-azaspiro[3.3]heptane-2-carboxamide
CID 144515655
3,8-dimethylspiro[4.4]nonane;ethane
CID 178108265
6-propan-2-yl-2-azaspiro[3.3]heptane-2-carboxamide
CID 89399831
(3R,8R)-3,8-dimethylspiro[4.4]nonane
CID 171400850
3-cyclopropyl-3-hydroxy-N,N-dimethylazetidine-1-carboxamide
CID 79154860
2,7-dimethylspiro[3.4]octane
CID 142902956
2-azaspiro[3.5]nonane-2-carboxamide
CID 130620195
4-carbamothioyl-N,N-dimethylpiperidine-1-carboxamide
CID 79154300
ethane;3-methylspiro[4.4]nonane
CID 168995417
1-N,1-N-dimethylazetidine-1,3-dicarboxamide
CID 130950203
ethane;4-hydroxy-N,N-dimethylpiperidine-1-carboxamide
CID 177000200

Frequently Asked Questions

What is the IUPAC name of ethane;6-methyl-2-azaspiro[3.4]octane-2-carboxamide;N,N,6-trimethyl-2-azaspiro[3.4]octane-2-carboxamide?
The IUPAC name of ethane;6-methyl-2-azaspiro[3.4]octane-2-carboxamide;N,N,6-trimethyl-2-azaspiro[3.4]octane-2-carboxamide (CID 144515769) is ethane;6-methyl-2-azaspiro[3.4]octane-2-carboxamide;N,N,6-trimethyl-2-azaspiro[3.4]octane-2-carboxamide.
What is the SMILES notation for ethane;6-methyl-2-azaspiro[3.4]octane-2-carboxamide;N,N,6-trimethyl-2-azaspiro[3.4]octane-2-carboxamide?
The canonical SMILES for ethane;6-methyl-2-azaspiro[3.4]octane-2-carboxamide;N,N,6-trimethyl-2-azaspiro[3.4]octane-2-carboxamide is CC.CC.CC.CC.CC1CCC2(C1)CN(C(=O)N(C)C)C2.CC1CCC2(C1)CN(C(N)=O)C2.
What is the InChIKey of ethane;6-methyl-2-azaspiro[3.4]octane-2-carboxamide;N,N,6-trimethyl-2-azaspiro[3.4]octane-2-carboxamide?
The InChIKey is WDCOPVHPDLTRPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O.C9H16N2O.4C2H6/c1-9-4-5-11(6-9)7-13(8-11)10(14)12(2)3;1-7-2-3-9(4-7)5-11(6-9)8(10)12;4*1-2/h9H,4-8H2,1-3H3;7H,2-6H2,1H3,(H2,10,12);4*1-2H3.
What are the key properties of ethane;6-methyl-2-azaspiro[3.4]octane-2-carboxamide;N,N,6-trimethyl-2-azaspiro[3.4]octane-2-carboxamide?
ethane;6-methyl-2-azaspiro[3.4]octane-2-carboxamide;N,N,6-trimethyl-2-azaspiro[3.4]octane-2-carboxamide has a molecular weight of 484.81 g/mol, XLogP of 7.08, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;6-methyl-2-azaspiro[3.4]octane-2-carboxamide;N,N,6-trimethyl-2-azaspiro[3.4]octane-2-carboxamide is sourced from PubChem (CID 144515769), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).