2-propyl-1,3-diazaspiro[4.4]non-1-en-4-one

C10H16N2O — CID 15818745

IUPAC2-propyl-1,3-diazaspiro[4.4]non-1-en-4-one
SMILESCCCC1=NC2(CCCC2)C(=O)N1
InChIInChI=1S/C10H16N2O/c1-2-5-8-11-9(13)10(12-8)6-3-4-7-10/h2-7H2,1H3,(H,11,12,13)
InChIKeyUFDYUXYOCBQELR-UHFFFAOYSA-N
MW180.25 g/mol
LogP1.63
Rot. Bonds2

About 2-propyl-1,3-diazaspiro[4.4]non-1-en-4-one

2-propyl-1,3-diazaspiro[4.4]non-1-en-4-one (PubChem CID 15818745) has the molecular formula C10H16N2O and a molecular weight of 180.25 g/mol. Its IUPAC name is 2-propyl-1,3-diazaspiro[4.4]non-1-en-4-one.

Molecular Properties

Compound Name2-propyl-1,3-diazaspiro[4.4]non-1-en-4-one
PubChem CID15818745
Molecular FormulaC10H16N2O
Molecular Weight180.25 g/mol
Exact Mass180.13
IUPAC Name2-propyl-1,3-diazaspiro[4.4]non-1-en-4-one
SMILESCCCC1=NC2(CCCC2)C(=O)N1
InChIInChI=1S/C10H16N2O/c1-2-5-8-11-9(13)10(12-8)6-3-4-7-10/h2-7H2,1H3,(H,11,12,13)
InChIKeyUFDYUXYOCBQELR-UHFFFAOYSA-N
XLogP1.63
TPSA41.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.25
LogP ≤ 51.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-propyl-1,3-diazaspiro[4.4]non-1-en-4-one?
The IUPAC name of 2-propyl-1,3-diazaspiro[4.4]non-1-en-4-one (CID 15818745) is 2-propyl-1,3-diazaspiro[4.4]non-1-en-4-one.
What is the SMILES notation for 2-propyl-1,3-diazaspiro[4.4]non-1-en-4-one?
The canonical SMILES for 2-propyl-1,3-diazaspiro[4.4]non-1-en-4-one is CCCC1=NC2(CCCC2)C(=O)N1.
What is the InChIKey of 2-propyl-1,3-diazaspiro[4.4]non-1-en-4-one?
The InChIKey is UFDYUXYOCBQELR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2O/c1-2-5-8-11-9(13)10(12-8)6-3-4-7-10/h2-7H2,1H3,(H,11,12,13).
What are the key properties of 2-propyl-1,3-diazaspiro[4.4]non-1-en-4-one?
2-propyl-1,3-diazaspiro[4.4]non-1-en-4-one has a molecular weight of 180.25 g/mol, XLogP of 1.63, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-propyl-1,3-diazaspiro[4.4]non-1-en-4-one is sourced from PubChem (CID 15818745), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).