(5S)-2,7-dimethyl-2,7-diazaspiro[4.5]decan-6-one;ethane;methane

C15H34N2O — CID 161052527

IUPAC(5S)-2,7-dimethyl-2,7-diazaspiro[4.5]decan-6-one;ethane;methane
SMILESC.CC.CC.CN1CC[C@@]2(CCCN(C)C2=O)C1
InChIInChI=1S/C10H18N2O.2C2H6.CH4/c1-11-7-5-10(8-11)4-3-6-12(2)9(10)13;2*1-2;/h3-8H2,1-2H3;2*1-2H3;1H4/t10-;;;/m0.../s1
InChIKeyUCIBJTXPTNOEAZ-KAFJHEIMSA-N
MW258.45 g/mol
LogP3.25
Rot. Bonds

About (5S)-2,7-dimethyl-2,7-diazaspiro[4.5]decan-6-one;ethane;methane

(5S)-2,7-dimethyl-2,7-diazaspiro[4.5]decan-6-one;ethane;methane (PubChem CID 161052527) has the molecular formula C15H34N2O and a molecular weight of 258.45 g/mol. Its IUPAC name is (5S)-2,7-dimethyl-2,7-diazaspiro[4.5]decan-6-one;ethane;methane.

Molecular Properties

Compound Name(5S)-2,7-dimethyl-2,7-diazaspiro[4.5]decan-6-one;ethane;methane
PubChem CID161052527
Molecular FormulaC15H34N2O
Molecular Weight258.45 g/mol
Exact Mass258.27
IUPAC Name(5S)-2,7-dimethyl-2,7-diazaspiro[4.5]decan-6-one;ethane;methane
SMILESC.CC.CC.CN1CC[C@@]2(CCCN(C)C2=O)C1
InChIInChI=1S/C10H18N2O.2C2H6.CH4/c1-11-7-5-10(8-11)4-3-6-12(2)9(10)13;2*1-2;/h3-8H2,1-2H3;2*1-2H3;1H4/t10-;;;/m0.../s1
InChIKeyUCIBJTXPTNOEAZ-KAFJHEIMSA-N
XLogP3.25
TPSA23.55 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.45
LogP ≤ 53.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

6-methyl-6-azaspiro[3.6]decan-5-one
CID 12509314
(5S)-2-(1,3-dihydroxypropan-2-yl)-7-methyl-2,7-diazaspiro[4.5]decan-6-one
CID 95209608
7-methyl-2-propan-2-yl-2,7-diazaspiro[4.4]nonan-1-one
CID 154959785
3,3-difluoro-1-methylpiperidin-2-one
CID 145310126
1-[(5R)-7-methyl-6-oxo-2,7-diazaspiro[4.5]decan-2-yl]-2-morpholin-4-ylethane-1,2-dione
CID 95221755
(4R)-6-methyl-6-azaspiro[3.5]nonan-3-one
CID 129450959
2-methyl-7-methylsulfanyl-2,7-diazaspiro[4.4]nonan-1-one
CID 171516524
7-methyl-7-azaspiro[4.5]decan-4-one;hydrochloride
CID 121207632
6-[(5R)-7-methyl-6-oxo-2,7-diazaspiro[4.5]decane-2-carbonyl]-1H-pyrimidine-2,4-dione
CID 95218005
2-[(3,5-dimethyl-1H-pyrazol-4-yl)sulfonyl]-7-methyl-2,7-diazaspiro[4.5]decan-6-one
CID 56740057
5,5-dimethyl-1-[2-(7-methyl-6-oxo-2,7-diazaspiro[4.5]decan-2-yl)-2-oxoethyl]imidazolidine-2,4-dione
CID 72934259
2,2-dimethylpropyl (5S)-7-methyl-6-oxo-2,7-diazaspiro[4.5]decane-2-carboxylate
CID 95200256

Frequently Asked Questions

What is the IUPAC name of (5S)-2,7-dimethyl-2,7-diazaspiro[4.5]decan-6-one;ethane;methane?
The IUPAC name of (5S)-2,7-dimethyl-2,7-diazaspiro[4.5]decan-6-one;ethane;methane (CID 161052527) is (5S)-2,7-dimethyl-2,7-diazaspiro[4.5]decan-6-one;ethane;methane.
What is the SMILES notation for (5S)-2,7-dimethyl-2,7-diazaspiro[4.5]decan-6-one;ethane;methane?
The canonical SMILES for (5S)-2,7-dimethyl-2,7-diazaspiro[4.5]decan-6-one;ethane;methane is C.CC.CC.CN1CC[C@@]2(CCCN(C)C2=O)C1.
What is the InChIKey of (5S)-2,7-dimethyl-2,7-diazaspiro[4.5]decan-6-one;ethane;methane?
The InChIKey is UCIBJTXPTNOEAZ-KAFJHEIMSA-N. The full InChI is InChI=1S/C10H18N2O.2C2H6.CH4/c1-11-7-5-10(8-11)4-3-6-12(2)9(10)13;2*1-2;/h3-8H2,1-2H3;2*1-2H3;1H4/t10-;;;/m0.../s1.
What are the key properties of (5S)-2,7-dimethyl-2,7-diazaspiro[4.5]decan-6-one;ethane;methane?
(5S)-2,7-dimethyl-2,7-diazaspiro[4.5]decan-6-one;ethane;methane has a molecular weight of 258.45 g/mol, XLogP of 3.25, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (5S)-2,7-dimethyl-2,7-diazaspiro[4.5]decan-6-one;ethane;methane is sourced from PubChem (CID 161052527), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).