2,2-dimethyl-1-(7-methyl-2,7-diazaspiro[4.4]nonan-2-yl)propan-1-one

C13H24N2O — CID 126750297

IUPAC2,2-dimethyl-1-(7-methyl-2,7-diazaspiro[4.4]nonan-2-yl)propan-1-one
SMILESCN1CCC2(CCN(C(=O)C(C)(C)C)C2)C1
InChIInChI=1S/C13H24N2O/c1-12(2,3)11(16)15-8-6-13(10-15)5-7-14(4)9-13/h5-10H2,1-4H3
InChIKeyFFSDEMJZUBSIOV-UHFFFAOYSA-N
MW224.35 g/mol
LogP1.59
Rot. Bonds

About 2,2-dimethyl-1-(7-methyl-2,7-diazaspiro[4.4]nonan-2-yl)propan-1-one

2,2-dimethyl-1-(7-methyl-2,7-diazaspiro[4.4]nonan-2-yl)propan-1-one (PubChem CID 126750297) has the molecular formula C13H24N2O and a molecular weight of 224.35 g/mol. Its IUPAC name is 2,2-dimethyl-1-(7-methyl-2,7-diazaspiro[4.4]nonan-2-yl)propan-1-one.

Molecular Properties

Compound Name2,2-dimethyl-1-(7-methyl-2,7-diazaspiro[4.4]nonan-2-yl)propan-1-one
PubChem CID126750297
Molecular FormulaC13H24N2O
Molecular Weight224.35 g/mol
Exact Mass224.19
IUPAC Name2,2-dimethyl-1-(7-methyl-2,7-diazaspiro[4.4]nonan-2-yl)propan-1-one
SMILESCN1CCC2(CCN(C(=O)C(C)(C)C)C2)C1
InChIInChI=1S/C13H24N2O/c1-12(2,3)11(16)15-8-6-13(10-15)5-7-14(4)9-13/h5-10H2,1-4H3
InChIKeyFFSDEMJZUBSIOV-UHFFFAOYSA-N
XLogP1.59
TPSA23.55 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.35
LogP ≤ 51.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2,2-dimethyl-1-(2-oxa-7-azaspiro[3.4]octan-7-yl)propan-1-one
CID 170540653
tert-butyl 7-methyl-2,7-diazaspiro[4.4]nonane-2-carboxylate
CID 118994126
1-(7-tert-butyl-2,7-diazaspiro[3.5]nonan-2-yl)-2,2-dimethylpropan-1-one
CID 176737009
1-(2-azaspiro[3.3]heptan-2-yl)-2,2-dimethylpropan-1-one
CID 130842982
2,7-dimethyl-2,7-diazaspiro[4.4]nonane;ethane
CID 144510455
2,2-dimethyl-1-(2-oxa-7-azaspiro[3.5]nonan-7-yl)propan-1-one
CID 126750142
N,N,8,11-tetramethyl-3,8,11-triazaspiro[5.6]dodecane-3-carboxamide
CID 168983400
2-methyl-2,6-diazaspiro[3.4]octane-6-carbonyl chloride
CID 131000866
2,2-dimethyl-1-(4-methylpiperazin-1-yl)propan-1-one
CID 3360236
2,2-dimethyl-1-(4-methylpiperazin-1-yl)propan-1-one
CID 158455362
2-(4-methylcyclohexyl)-1-[(5S)-7-methyl-2,7-diazaspiro[4.4]nonan-2-yl]ethanone
CID 164633620
2-anilino-2-methyl-1-(2-methyl-2,8-diazaspiro[4.5]decan-8-yl)propan-1-one
CID 50953250

Frequently Asked Questions

What is the IUPAC name of 2,2-dimethyl-1-(7-methyl-2,7-diazaspiro[4.4]nonan-2-yl)propan-1-one?
The IUPAC name of 2,2-dimethyl-1-(7-methyl-2,7-diazaspiro[4.4]nonan-2-yl)propan-1-one (CID 126750297) is 2,2-dimethyl-1-(7-methyl-2,7-diazaspiro[4.4]nonan-2-yl)propan-1-one.
What is the SMILES notation for 2,2-dimethyl-1-(7-methyl-2,7-diazaspiro[4.4]nonan-2-yl)propan-1-one?
The canonical SMILES for 2,2-dimethyl-1-(7-methyl-2,7-diazaspiro[4.4]nonan-2-yl)propan-1-one is CN1CCC2(CCN(C(=O)C(C)(C)C)C2)C1.
What is the InChIKey of 2,2-dimethyl-1-(7-methyl-2,7-diazaspiro[4.4]nonan-2-yl)propan-1-one?
The InChIKey is FFSDEMJZUBSIOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O/c1-12(2,3)11(16)15-8-6-13(10-15)5-7-14(4)9-13/h5-10H2,1-4H3.
What are the key properties of 2,2-dimethyl-1-(7-methyl-2,7-diazaspiro[4.4]nonan-2-yl)propan-1-one?
2,2-dimethyl-1-(7-methyl-2,7-diazaspiro[4.4]nonan-2-yl)propan-1-one has a molecular weight of 224.35 g/mol, XLogP of 1.59, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyl-1-(7-methyl-2,7-diazaspiro[4.4]nonan-2-yl)propan-1-one is sourced from PubChem (CID 126750297), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).