10-propan-2-yl-7,10-diazaspiro[4.6]undecan-11-one

C12H22N2O — CID 115100278

IUPAC10-propan-2-yl-7,10-diazaspiro[4.6]undecan-11-one
SMILESCC(C)N1CCNCC2(CCCC2)C1=O
InChIInChI=1S/C12H22N2O/c1-10(2)14-8-7-13-9-12(11(14)15)5-3-4-6-12/h10,13H,3-9H2,1-2H3
InChIKeyWGHGVNZUWGECAT-UHFFFAOYSA-N
MW210.32 g/mol
LogP1.39
Rot. Bonds1

About 10-propan-2-yl-7,10-diazaspiro[4.6]undecan-11-one

10-propan-2-yl-7,10-diazaspiro[4.6]undecan-11-one (PubChem CID 115100278) has the molecular formula C12H22N2O and a molecular weight of 210.32 g/mol. Its IUPAC name is 10-propan-2-yl-7,10-diazaspiro[4.6]undecan-11-one.

Molecular Properties

Compound Name10-propan-2-yl-7,10-diazaspiro[4.6]undecan-11-one
PubChem CID115100278
Molecular FormulaC12H22N2O
Molecular Weight210.32 g/mol
Exact Mass210.17
IUPAC Name10-propan-2-yl-7,10-diazaspiro[4.6]undecan-11-one
SMILESCC(C)N1CCNCC2(CCCC2)C1=O
InChIInChI=1S/C12H22N2O/c1-10(2)14-8-7-13-9-12(11(14)15)5-3-4-6-12/h10,13H,3-9H2,1-2H3
InChIKeyWGHGVNZUWGECAT-UHFFFAOYSA-N
XLogP1.39
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.32
LogP ≤ 51.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 10-propan-2-yl-7,10-diazaspiro[4.6]undecan-11-one?
The IUPAC name of 10-propan-2-yl-7,10-diazaspiro[4.6]undecan-11-one (CID 115100278) is 10-propan-2-yl-7,10-diazaspiro[4.6]undecan-11-one.
What is the SMILES notation for 10-propan-2-yl-7,10-diazaspiro[4.6]undecan-11-one?
The canonical SMILES for 10-propan-2-yl-7,10-diazaspiro[4.6]undecan-11-one is CC(C)N1CCNCC2(CCCC2)C1=O.
What is the InChIKey of 10-propan-2-yl-7,10-diazaspiro[4.6]undecan-11-one?
The InChIKey is WGHGVNZUWGECAT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N2O/c1-10(2)14-8-7-13-9-12(11(14)15)5-3-4-6-12/h10,13H,3-9H2,1-2H3.
What are the key properties of 10-propan-2-yl-7,10-diazaspiro[4.6]undecan-11-one?
10-propan-2-yl-7,10-diazaspiro[4.6]undecan-11-one has a molecular weight of 210.32 g/mol, XLogP of 1.39, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 10-propan-2-yl-7,10-diazaspiro[4.6]undecan-11-one is sourced from PubChem (CID 115100278), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).