6-propan-2-yl-4,6-diazaspiro[2.4]heptane

C8H16N2 — CID 167340247

IUPAC6-propan-2-yl-4,6-diazaspiro[2.4]heptane
SMILESCC(C)N1CNC2(CC2)C1
InChIInChI=1S/C8H16N2/c1-7(2)10-5-8(3-4-8)9-6-10/h7,9H,3-6H2,1-2H3
InChIKeyMSOZQVCHBWCOSF-UHFFFAOYSA-N
MW140.23 g/mol
LogP0.79
Rot. Bonds1

About 6-propan-2-yl-4,6-diazaspiro[2.4]heptane

6-propan-2-yl-4,6-diazaspiro[2.4]heptane (PubChem CID 167340247) has the molecular formula C8H16N2 and a molecular weight of 140.23 g/mol. Its IUPAC name is 6-propan-2-yl-4,6-diazaspiro[2.4]heptane.

Molecular Properties

Compound Name6-propan-2-yl-4,6-diazaspiro[2.4]heptane
PubChem CID167340247
Molecular FormulaC8H16N2
Molecular Weight140.23 g/mol
Exact Mass140.13
IUPAC Name6-propan-2-yl-4,6-diazaspiro[2.4]heptane
SMILESCC(C)N1CNC2(CC2)C1
InChIInChI=1S/C8H16N2/c1-7(2)10-5-8(3-4-8)9-6-10/h7,9H,3-6H2,1-2H3
InChIKeyMSOZQVCHBWCOSF-UHFFFAOYSA-N
XLogP0.79
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500140.23
LogP ≤ 50.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

6-propan-2-yl-1,6-diazaspiro[2.4]heptane
CID 155640500
4-propan-2-yl-1,4,9-triazaspiro[5.5]undecane
CID 139359285
molecular hydrogen;8-propan-2-yl-1,8-diazaspiro[3.5]nonane
CID 170571753
6-propan-2-yl-1,6-diazaspiro[2.5]octane
CID 58584452
9-(3-methylbutan-2-yl)-6,9-diazaspiro[4.5]decane
CID 64923852
(4S)-7-propan-2-yl-1,7-diazaspiro[3.4]octan-2-one
CID 97174895
2,6-di(propan-2-yl)-2,6-diazaspiro[3.3]heptane
CID 20781150
3-methyl-1-propan-2-ylazetidin-3-ol
CID 58334516
3-methyl-8-propan-2-yl-1,3,8-triazaspiro[4.5]decan-4-one
CID 59128621
2-propan-2-yl-2-azaspiro[3.4]octane
CID 118357245
2-propan-2-yl-2-azaspiro[3.5]nonan-7-imine
CID 170719041
(4S)-8-propan-2-yl-5-oxa-1,8-diazaspiro[3.5]nonane
CID 171423140

Frequently Asked Questions

What is the IUPAC name of 6-propan-2-yl-4,6-diazaspiro[2.4]heptane?
The IUPAC name of 6-propan-2-yl-4,6-diazaspiro[2.4]heptane (CID 167340247) is 6-propan-2-yl-4,6-diazaspiro[2.4]heptane.
What is the SMILES notation for 6-propan-2-yl-4,6-diazaspiro[2.4]heptane?
The canonical SMILES for 6-propan-2-yl-4,6-diazaspiro[2.4]heptane is CC(C)N1CNC2(CC2)C1.
What is the InChIKey of 6-propan-2-yl-4,6-diazaspiro[2.4]heptane?
The InChIKey is MSOZQVCHBWCOSF-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16N2/c1-7(2)10-5-8(3-4-8)9-6-10/h7,9H,3-6H2,1-2H3.
What are the key properties of 6-propan-2-yl-4,6-diazaspiro[2.4]heptane?
6-propan-2-yl-4,6-diazaspiro[2.4]heptane has a molecular weight of 140.23 g/mol, XLogP of 0.79, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-propan-2-yl-4,6-diazaspiro[2.4]heptane is sourced from PubChem (CID 167340247), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).