butane;6-methyl-2-azaspiro[3.3]heptane-2-carboxamide

C12H24N2O — CID 144515655

IUPACbutane;6-methyl-2-azaspiro[3.3]heptane-2-carboxamide
SMILESCC1CC2(C1)CN(C(N)=O)C2.CCCC
InChIInChI=1S/C8H14N2O.C4H10/c1-6-2-8(3-6)4-10(5-8)7(9)11;1-3-4-2/h6H,2-5H2,1H3,(H2,9,11);3-4H2,1-2H3
InChIKeyDDZSMTFEBFIBNF-UHFFFAOYSA-N
MW212.34 g/mol
LogP2.60
Rot. Bonds1

About butane;6-methyl-2-azaspiro[3.3]heptane-2-carboxamide

butane;6-methyl-2-azaspiro[3.3]heptane-2-carboxamide (PubChem CID 144515655) has the molecular formula C12H24N2O and a molecular weight of 212.34 g/mol. Its IUPAC name is butane;6-methyl-2-azaspiro[3.3]heptane-2-carboxamide.

Molecular Properties

Compound Namebutane;6-methyl-2-azaspiro[3.3]heptane-2-carboxamide
PubChem CID144515655
Molecular FormulaC12H24N2O
Molecular Weight212.34 g/mol
Exact Mass212.19
IUPAC Namebutane;6-methyl-2-azaspiro[3.3]heptane-2-carboxamide
SMILESCC1CC2(C1)CN(C(N)=O)C2.CCCC
InChIInChI=1S/C8H14N2O.C4H10/c1-6-2-8(3-6)4-10(5-8)7(9)11;1-3-4-2/h6H,2-5H2,1H3,(H2,9,11);3-4H2,1-2H3
InChIKeyDDZSMTFEBFIBNF-UHFFFAOYSA-N
XLogP2.60
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.34
LogP ≤ 52.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

6-propan-2-yl-2-azaspiro[3.3]heptane-2-carboxamide
CID 89399831
N-(2-aminoethyl)-6-methyl-2-azaspiro[3.3]heptane-2-carboxamide
CID 166864806
ethane;6-methyl-2-azaspiro[3.4]octane-2-carboxamide;N,N,6-trimethyl-2-azaspiro[3.4]octane-2-carboxamide
CID 144515769
2-ethylsulfonyl-2,6-diazaspiro[3.3]heptane-6-carboxamide
CID 142458772
(1E,3Z)-1-(6-methyl-2-azaspiro[3.3]heptan-2-yl)penta-1,3-diene-1,4-diamine
CID 134406468
2-(6-methyl-2-azaspiro[3.3]heptan-2-yl)pentan-3-one
CID 163725007
6-methylspiro[3.3]heptane-2-carboxamide
CID 90369734
2-azaspiro[3.5]nonane-2-carboxamide
CID 130620195
3-amino-3-ethylpyrrolidine-1-carboxamide
CID 163727022
2-[4-(cyclobutylmethyl)piperazin-1-yl]-1-(6-methyl-2-azaspiro[3.3]heptan-2-yl)ethanone
CID 167550936
(3R,4S)-3-ethyl-4-methylpyrrolidine-1-carboxamide
CID 95049046
butane;1,2,2,4,6,6-hexamethylpiperidine;methane
CID 158536756

Frequently Asked Questions

What is the IUPAC name of butane;6-methyl-2-azaspiro[3.3]heptane-2-carboxamide?
The IUPAC name of butane;6-methyl-2-azaspiro[3.3]heptane-2-carboxamide (CID 144515655) is butane;6-methyl-2-azaspiro[3.3]heptane-2-carboxamide.
What is the SMILES notation for butane;6-methyl-2-azaspiro[3.3]heptane-2-carboxamide?
The canonical SMILES for butane;6-methyl-2-azaspiro[3.3]heptane-2-carboxamide is CC1CC2(C1)CN(C(N)=O)C2.CCCC.
What is the InChIKey of butane;6-methyl-2-azaspiro[3.3]heptane-2-carboxamide?
The InChIKey is DDZSMTFEBFIBNF-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N2O.C4H10/c1-6-2-8(3-6)4-10(5-8)7(9)11;1-3-4-2/h6H,2-5H2,1H3,(H2,9,11);3-4H2,1-2H3.
What are the key properties of butane;6-methyl-2-azaspiro[3.3]heptane-2-carboxamide?
butane;6-methyl-2-azaspiro[3.3]heptane-2-carboxamide has a molecular weight of 212.34 g/mol, XLogP of 2.60, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for butane;6-methyl-2-azaspiro[3.3]heptane-2-carboxamide is sourced from PubChem (CID 144515655), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).