ethane;6-methyl-2-azaspiro[3.4]octane-2-carboxamide;2-methylpropane

C17H38N2O — CID 144515718

IUPACethane;6-methyl-2-azaspiro[3.4]octane-2-carboxamide;2-methylpropane
SMILESCC.CC.CC(C)C.CC1CCC2(C1)CN(C(N)=O)C2
InChIInChI=1S/C9H16N2O.C4H10.2C2H6/c1-7-2-3-9(4-7)5-11(6-9)8(10)12;1-4(2)3;2*1-2/h7H,2-6H2,1H3,(H2,10,12);4H,1-3H3;2*1-2H3
InChIKeyNKVVWSMFCFSVSP-UHFFFAOYSA-N
MW286.50 g/mol
LogP4.90
Rot. Bonds

About ethane;6-methyl-2-azaspiro[3.4]octane-2-carboxamide;2-methylpropane

ethane;6-methyl-2-azaspiro[3.4]octane-2-carboxamide;2-methylpropane (PubChem CID 144515718) has the molecular formula C17H38N2O and a molecular weight of 286.50 g/mol. Its IUPAC name is ethane;6-methyl-2-azaspiro[3.4]octane-2-carboxamide;2-methylpropane.

Molecular Properties

Compound Nameethane;6-methyl-2-azaspiro[3.4]octane-2-carboxamide;2-methylpropane
PubChem CID144515718
Molecular FormulaC17H38N2O
Molecular Weight286.50 g/mol
Exact Mass286.30
IUPAC Nameethane;6-methyl-2-azaspiro[3.4]octane-2-carboxamide;2-methylpropane
SMILESCC.CC.CC(C)C.CC1CCC2(C1)CN(C(N)=O)C2
InChIInChI=1S/C9H16N2O.C4H10.2C2H6/c1-7-2-3-9(4-7)5-11(6-9)8(10)12;1-4(2)3;2*1-2/h7H,2-6H2,1H3,(H2,10,12);4H,1-3H3;2*1-2H3
InChIKeyNKVVWSMFCFSVSP-UHFFFAOYSA-N
XLogP4.90
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.50
LogP ≤ 54.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of ethane;6-methyl-2-azaspiro[3.4]octane-2-carboxamide;2-methylpropane?
The IUPAC name of ethane;6-methyl-2-azaspiro[3.4]octane-2-carboxamide;2-methylpropane (CID 144515718) is ethane;6-methyl-2-azaspiro[3.4]octane-2-carboxamide;2-methylpropane.
What is the SMILES notation for ethane;6-methyl-2-azaspiro[3.4]octane-2-carboxamide;2-methylpropane?
The canonical SMILES for ethane;6-methyl-2-azaspiro[3.4]octane-2-carboxamide;2-methylpropane is CC.CC.CC(C)C.CC1CCC2(C1)CN(C(N)=O)C2.
What is the InChIKey of ethane;6-methyl-2-azaspiro[3.4]octane-2-carboxamide;2-methylpropane?
The InChIKey is NKVVWSMFCFSVSP-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N2O.C4H10.2C2H6/c1-7-2-3-9(4-7)5-11(6-9)8(10)12;1-4(2)3;2*1-2/h7H,2-6H2,1H3,(H2,10,12);4H,1-3H3;2*1-2H3.
What are the key properties of ethane;6-methyl-2-azaspiro[3.4]octane-2-carboxamide;2-methylpropane?
ethane;6-methyl-2-azaspiro[3.4]octane-2-carboxamide;2-methylpropane has a molecular weight of 286.50 g/mol, XLogP of 4.90, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;6-methyl-2-azaspiro[3.4]octane-2-carboxamide;2-methylpropane is sourced from PubChem (CID 144515718), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).