ethane;(8S)-8-methyl-5-azaspiro[3.5]nonane

C11H23N — CID 169125658

IUPACethane;(8S)-8-methyl-5-azaspiro[3.5]nonane
SMILESCC.C[C@H]1CCNC2(CCC2)C1
InChIInChI=1S/C9H17N.C2H6/c1-8-3-6-10-9(7-8)4-2-5-9;1-2/h8,10H,2-7H2,1H3;1-2H3/t8-;/m0./s1
InChIKeyJMNMHQABAHSXIT-QRPNPIFTSA-N
MW169.31 g/mol
LogP2.95
Rot. Bonds

About ethane;(8S)-8-methyl-5-azaspiro[3.5]nonane

ethane;(8S)-8-methyl-5-azaspiro[3.5]nonane (PubChem CID 169125658) has the molecular formula C11H23N and a molecular weight of 169.31 g/mol. Its IUPAC name is ethane;(8S)-8-methyl-5-azaspiro[3.5]nonane.

Molecular Properties

Compound Nameethane;(8S)-8-methyl-5-azaspiro[3.5]nonane
PubChem CID169125658
Molecular FormulaC11H23N
Molecular Weight169.31 g/mol
Exact Mass169.18
IUPAC Nameethane;(8S)-8-methyl-5-azaspiro[3.5]nonane
SMILESCC.C[C@H]1CCNC2(CCC2)C1
InChIInChI=1S/C9H17N.C2H6/c1-8-3-6-10-9(7-8)4-2-5-9;1-2/h8,10H,2-7H2,1H3;1-2H3/t8-;/m0./s1
InChIKeyJMNMHQABAHSXIT-QRPNPIFTSA-N
XLogP2.95
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.31
LogP ≤ 52.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

8-methyl-5-azaspiro[3.5]nonane
CID 89432250
(7R)-7-methyl-4-azaspiro[2.5]octane
CID 155722557
4-(4-methylpiperidin-1-yl)-1-azaspiro[5.5]undecane
CID 79678092
(8R)-5-azaspiro[3.5]nonan-8-ol
CID 96637049
8-iodo-5-azaspiro[3.5]nonane
CID 170139848
(8R)-8-tert-butyl-5-azaspiro[3.5]nonane
CID 171594365
6-methyl-1-azaspiro[3.3]heptane
CID 103565322
3-methyl-1-azaspiro[4.5]decane
CID 154321792
5-methyl-1-azaspiro[2.4]heptane
CID 142790664
N,N-dimethyl-1-azaspiro[5.5]undecan-4-amine
CID 79678093
7,8-dimethyl-1-azaspiro[4.4]nonane
CID 2772323
4-(5-azaspiro[3.5]nonan-8-yl)morpholine
CID 79677979

Frequently Asked Questions

What is the IUPAC name of ethane;(8S)-8-methyl-5-azaspiro[3.5]nonane?
The IUPAC name of ethane;(8S)-8-methyl-5-azaspiro[3.5]nonane (CID 169125658) is ethane;(8S)-8-methyl-5-azaspiro[3.5]nonane.
What is the SMILES notation for ethane;(8S)-8-methyl-5-azaspiro[3.5]nonane?
The canonical SMILES for ethane;(8S)-8-methyl-5-azaspiro[3.5]nonane is CC.C[C@H]1CCNC2(CCC2)C1.
What is the InChIKey of ethane;(8S)-8-methyl-5-azaspiro[3.5]nonane?
The InChIKey is JMNMHQABAHSXIT-QRPNPIFTSA-N. The full InChI is InChI=1S/C9H17N.C2H6/c1-8-3-6-10-9(7-8)4-2-5-9;1-2/h8,10H,2-7H2,1H3;1-2H3/t8-;/m0./s1.
What are the key properties of ethane;(8S)-8-methyl-5-azaspiro[3.5]nonane?
ethane;(8S)-8-methyl-5-azaspiro[3.5]nonane has a molecular weight of 169.31 g/mol, XLogP of 2.95, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;(8S)-8-methyl-5-azaspiro[3.5]nonane is sourced from PubChem (CID 169125658), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).