1-[(3S)-7-azaspiro[3.5]nonan-3-yl]propane-2-sulfinamide

C11H22N2OS — CID 140765886

IUPAC1-[(3S)-7-azaspiro[3.5]nonan-3-yl]propane-2-sulfinamide
SMILESCC(C[C@@H]1CCC12CCNCC2)S(N)=O
InChIInChI=1S/C11H22N2OS/c1-9(15(12)14)8-10-2-3-11(10)4-6-13-7-5-11/h9-10,13H,2-8,12H2,1H3/t9?,10-,15?/m0/s1
InChIKeyAQODEJUBVQSAGI-VOZQYIJBSA-N
MW230.38 g/mol
LogP1.17
Rot. Bonds3

About 1-[(3S)-7-azaspiro[3.5]nonan-3-yl]propane-2-sulfinamide

1-[(3S)-7-azaspiro[3.5]nonan-3-yl]propane-2-sulfinamide (PubChem CID 140765886) has the molecular formula C11H22N2OS and a molecular weight of 230.38 g/mol. Its IUPAC name is 1-[(3S)-7-azaspiro[3.5]nonan-3-yl]propane-2-sulfinamide.

Molecular Properties

Compound Name1-[(3S)-7-azaspiro[3.5]nonan-3-yl]propane-2-sulfinamide
PubChem CID140765886
Molecular FormulaC11H22N2OS
Molecular Weight230.38 g/mol
Exact Mass230.15
IUPAC Name1-[(3S)-7-azaspiro[3.5]nonan-3-yl]propane-2-sulfinamide
SMILESCC(C[C@@H]1CCC12CCNCC2)S(N)=O
InChIInChI=1S/C11H22N2OS/c1-9(15(12)14)8-10-2-3-11(10)4-6-13-7-5-11/h9-10,13H,2-8,12H2,1H3/t9?,10-,15?/m0/s1
InChIKeyAQODEJUBVQSAGI-VOZQYIJBSA-N
XLogP1.17
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.38
LogP ≤ 51.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

1-[(4S)-spiro[4,6-dihydropyrrolo[1,2-c]triazole-5,4'-piperidine]-4-yl]propane-2-sulfinamide
CID 171768744
1-(6-azaspiro[2.5]octan-2-yl)propan-2-amine
CID 84653194
7-(2-methylpropyl)-2-azaspiro[3.3]heptane
CID 155087784
2-(2-methylpropyl)-6-azaspiro[2.5]octane
CID 115013358
9-methyl-5-(2-methylpropyl)-3-azaspiro[5.6]dodecane
CID 79320901
1-[(4S)-4-methyl-2-oxa-8-azaspiro[4.5]decan-4-yl]propane-2-sulfinamide
CID 156624820
3-methyl-11-(2-methylpropyl)-3,9-diazaspiro[5.5]undecane
CID 79321099
4-methyl-3-propan-2-yl-8-azaspiro[4.5]decane
CID 172612462
(3S,4R)-3-methyl-8-azaspiro[4.5]decan-4-amine
CID 166495002
(R)-2-methyl-N-[(4R)-3-methyl-8-azaspiro[4.5]decan-4-yl]butane-2-sulfinamide
CID 135294468
9-propan-2-yl-5-propyl-3-azaspiro[5.6]dodecane
CID 79321593
9-methyl-5-(2-methylpropyl)-3,9-diazaspiro[5.6]dodecane
CID 79320211

Frequently Asked Questions

What is the IUPAC name of 1-[(3S)-7-azaspiro[3.5]nonan-3-yl]propane-2-sulfinamide?
The IUPAC name of 1-[(3S)-7-azaspiro[3.5]nonan-3-yl]propane-2-sulfinamide (CID 140765886) is 1-[(3S)-7-azaspiro[3.5]nonan-3-yl]propane-2-sulfinamide.
What is the SMILES notation for 1-[(3S)-7-azaspiro[3.5]nonan-3-yl]propane-2-sulfinamide?
The canonical SMILES for 1-[(3S)-7-azaspiro[3.5]nonan-3-yl]propane-2-sulfinamide is CC(C[C@@H]1CCC12CCNCC2)S(N)=O.
What is the InChIKey of 1-[(3S)-7-azaspiro[3.5]nonan-3-yl]propane-2-sulfinamide?
The InChIKey is AQODEJUBVQSAGI-VOZQYIJBSA-N. The full InChI is InChI=1S/C11H22N2OS/c1-9(15(12)14)8-10-2-3-11(10)4-6-13-7-5-11/h9-10,13H,2-8,12H2,1H3/t9?,10-,15?/m0/s1.
What are the key properties of 1-[(3S)-7-azaspiro[3.5]nonan-3-yl]propane-2-sulfinamide?
1-[(3S)-7-azaspiro[3.5]nonan-3-yl]propane-2-sulfinamide has a molecular weight of 230.38 g/mol, XLogP of 1.17, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(3S)-7-azaspiro[3.5]nonan-3-yl]propane-2-sulfinamide is sourced from PubChem (CID 140765886), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).