ethane;2-ethyl-7-propan-2-yl-2,7-diazaspiro[3.4]octane

C13H28N2 — CID 156798626

IUPACethane;2-ethyl-7-propan-2-yl-2,7-diazaspiro[3.4]octane
SMILESCC.CCN1CC2(CCN(C(C)C)C2)C1
InChIInChI=1S/C11H22N2.C2H6/c1-4-12-7-11(8-12)5-6-13(9-11)10(2)3;1-2/h10H,4-9H2,1-3H3;1-2H3
InChIKeyKPOGWLHRLDVJIA-UHFFFAOYSA-N
MW212.38 g/mol
LogP2.45
Rot. Bonds2

About ethane;2-ethyl-7-propan-2-yl-2,7-diazaspiro[3.4]octane

ethane;2-ethyl-7-propan-2-yl-2,7-diazaspiro[3.4]octane (PubChem CID 156798626) has the molecular formula C13H28N2 and a molecular weight of 212.38 g/mol. Its IUPAC name is ethane;2-ethyl-7-propan-2-yl-2,7-diazaspiro[3.4]octane.

Molecular Properties

Compound Nameethane;2-ethyl-7-propan-2-yl-2,7-diazaspiro[3.4]octane
PubChem CID156798626
Molecular FormulaC13H28N2
Molecular Weight212.38 g/mol
Exact Mass212.23
IUPAC Nameethane;2-ethyl-7-propan-2-yl-2,7-diazaspiro[3.4]octane
SMILESCC.CCN1CC2(CCN(C(C)C)C2)C1
InChIInChI=1S/C11H22N2.C2H6/c1-4-12-7-11(8-12)5-6-13(9-11)10(2)3;1-2/h10H,4-9H2,1-3H3;1-2H3
InChIKeyKPOGWLHRLDVJIA-UHFFFAOYSA-N
XLogP2.45
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.38
LogP ≤ 52.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

ethane;7-ethyl-2-propan-2-yl-2,7-diazaspiro[4.4]nonane
CID 164540860
2-(2-methoxyethyl)-7-propan-2-yl-2,7-diazaspiro[3.4]octane
CID 156546425
ethane;methane;2-methyl-6-propan-2-yl-2,6-diazaspiro[3.4]octane
CID 162125868
2,6-di(propan-2-yl)-2,6-diazaspiro[3.3]heptane;2,7-di(propan-2-yl)-2,7-diazaspiro[4.4]nonane
CID 163848476
2,2-difluoro-6-propan-2-yl-6-azaspiro[3.4]octane;ethane
CID 170740276
ethane;2-propan-2-yl-2-azaspiro[4.5]decane
CID 144877753
ethane;7-propan-2-yl-2-oxa-7-azaspiro[3.4]octane
CID 158223756
ethane;7-methyl-2-propan-2-yl-2,7-diazaspiro[4.4]nonane
CID 145449305
2,9-di(propan-2-yl)-2,9-diazaspiro[5.5]undecane;ethane
CID 172605205
ethane;8-ethyl-6,6-difluoro-2-propan-2-yl-2,8-diazaspiro[4.5]decane
CID 176558131
2-ethyl-7-methyl-2,7-diazaspiro[3.4]octane
CID 59304538
7-propan-2-yl-2-[(2-propan-2-yl-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-5-yl)methyl]-2,7-diazaspiro[3.4]octane
CID 167417400

Frequently Asked Questions

What is the IUPAC name of ethane;2-ethyl-7-propan-2-yl-2,7-diazaspiro[3.4]octane?
The IUPAC name of ethane;2-ethyl-7-propan-2-yl-2,7-diazaspiro[3.4]octane (CID 156798626) is ethane;2-ethyl-7-propan-2-yl-2,7-diazaspiro[3.4]octane.
What is the SMILES notation for ethane;2-ethyl-7-propan-2-yl-2,7-diazaspiro[3.4]octane?
The canonical SMILES for ethane;2-ethyl-7-propan-2-yl-2,7-diazaspiro[3.4]octane is CC.CCN1CC2(CCN(C(C)C)C2)C1.
What is the InChIKey of ethane;2-ethyl-7-propan-2-yl-2,7-diazaspiro[3.4]octane?
The InChIKey is KPOGWLHRLDVJIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2.C2H6/c1-4-12-7-11(8-12)5-6-13(9-11)10(2)3;1-2/h10H,4-9H2,1-3H3;1-2H3.
What are the key properties of ethane;2-ethyl-7-propan-2-yl-2,7-diazaspiro[3.4]octane?
ethane;2-ethyl-7-propan-2-yl-2,7-diazaspiro[3.4]octane has a molecular weight of 212.38 g/mol, XLogP of 2.45, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;2-ethyl-7-propan-2-yl-2,7-diazaspiro[3.4]octane is sourced from PubChem (CID 156798626), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).