2,7-dimethyl-2,7-diazaspiro[3.4]octane;ethane;2-methyl-2,7-diazaspiro[3.5]nonane

C20H44N4 — CID 169136114

IUPAC2,7-dimethyl-2,7-diazaspiro[3.4]octane;ethane;2-methyl-2,7-diazaspiro[3.5]nonane
SMILESCC.CC.CN1CC2(CCNCC2)C1.CN1CCC2(C1)CN(C)C2
InChIInChI=1S/2C8H16N2.2C2H6/c1-9-4-3-8(5-9)6-10(2)7-8;1-10-6-8(7-10)2-4-9-5-3-8;2*1-2/h3-7H2,1-2H3;9H,2-7H2,1H3;2*1-2H3
InChIKeyKUXSTDZOABQEIO-UHFFFAOYSA-N
MW340.60 g/mol
LogP2.61
Rot. Bonds

About 2,7-dimethyl-2,7-diazaspiro[3.4]octane;ethane;2-methyl-2,7-diazaspiro[3.5]nonane

2,7-dimethyl-2,7-diazaspiro[3.4]octane;ethane;2-methyl-2,7-diazaspiro[3.5]nonane (PubChem CID 169136114) has the molecular formula C20H44N4 and a molecular weight of 340.60 g/mol. Its IUPAC name is 2,7-dimethyl-2,7-diazaspiro[3.4]octane;ethane;2-methyl-2,7-diazaspiro[3.5]nonane.

Molecular Properties

Compound Name2,7-dimethyl-2,7-diazaspiro[3.4]octane;ethane;2-methyl-2,7-diazaspiro[3.5]nonane
PubChem CID169136114
Molecular FormulaC20H44N4
Molecular Weight340.60 g/mol
Exact Mass340.36
IUPAC Name2,7-dimethyl-2,7-diazaspiro[3.4]octane;ethane;2-methyl-2,7-diazaspiro[3.5]nonane
SMILESCC.CC.CN1CC2(CCNCC2)C1.CN1CCC2(C1)CN(C)C2
InChIInChI=1S/2C8H16N2.2C2H6/c1-9-4-3-8(5-9)6-10(2)7-8;1-10-6-8(7-10)2-4-9-5-3-8;2*1-2/h3-7H2,1-2H3;9H,2-7H2,1H3;2*1-2H3
InChIKeyKUXSTDZOABQEIO-UHFFFAOYSA-N
XLogP2.61
TPSA21.75 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms24
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.60
LogP ≤ 52.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2,7-dimethyl-2,7-diazaspiro[3.4]octane;ethane;2-methyl-2,7-diazaspiro[3.5]nonane?
The IUPAC name of 2,7-dimethyl-2,7-diazaspiro[3.4]octane;ethane;2-methyl-2,7-diazaspiro[3.5]nonane (CID 169136114) is 2,7-dimethyl-2,7-diazaspiro[3.4]octane;ethane;2-methyl-2,7-diazaspiro[3.5]nonane.
What is the SMILES notation for 2,7-dimethyl-2,7-diazaspiro[3.4]octane;ethane;2-methyl-2,7-diazaspiro[3.5]nonane?
The canonical SMILES for 2,7-dimethyl-2,7-diazaspiro[3.4]octane;ethane;2-methyl-2,7-diazaspiro[3.5]nonane is CC.CC.CN1CC2(CCNCC2)C1.CN1CCC2(C1)CN(C)C2.
What is the InChIKey of 2,7-dimethyl-2,7-diazaspiro[3.4]octane;ethane;2-methyl-2,7-diazaspiro[3.5]nonane?
The InChIKey is KUXSTDZOABQEIO-UHFFFAOYSA-N. The full InChI is InChI=1S/2C8H16N2.2C2H6/c1-9-4-3-8(5-9)6-10(2)7-8;1-10-6-8(7-10)2-4-9-5-3-8;2*1-2/h3-7H2,1-2H3;9H,2-7H2,1H3;2*1-2H3.
What are the key properties of 2,7-dimethyl-2,7-diazaspiro[3.4]octane;ethane;2-methyl-2,7-diazaspiro[3.5]nonane?
2,7-dimethyl-2,7-diazaspiro[3.4]octane;ethane;2-methyl-2,7-diazaspiro[3.5]nonane has a molecular weight of 340.60 g/mol, XLogP of 2.61, 0 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,7-dimethyl-2,7-diazaspiro[3.4]octane;ethane;2-methyl-2,7-diazaspiro[3.5]nonane is sourced from PubChem (CID 169136114), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).