2-cyclopropylimino-7-(2-methylpropyl)-1,3-diazaspiro[4.5]decan-4-one

C15H25N3O — CID 136734054

IUPAC2-cyclopropylimino-7-(2-methylpropyl)-1,3-diazaspiro[4.5]decan-4-one
SMILESCC(C)CC1CCCC2(C1)N/C(=N/C1CC1)NC2=O
InChIInChI=1S/C15H25N3O/c1-10(2)8-11-4-3-7-15(9-11)13(19)17-14(18-15)16-12-5-6-12/h10-12H,3-9H2,1-2H3,(H2,16,17,18,19)
InChIKeyUZJBMKUTVZKNBZ-UHFFFAOYSA-N
MW263.38 g/mol
LogP2.20
Rot. Bonds3

About 2-cyclopropylimino-7-(2-methylpropyl)-1,3-diazaspiro[4.5]decan-4-one

2-cyclopropylimino-7-(2-methylpropyl)-1,3-diazaspiro[4.5]decan-4-one (PubChem CID 136734054) has the molecular formula C15H25N3O and a molecular weight of 263.38 g/mol. Its IUPAC name is 2-cyclopropylimino-7-(2-methylpropyl)-1,3-diazaspiro[4.5]decan-4-one.

Molecular Properties

Compound Name2-cyclopropylimino-7-(2-methylpropyl)-1,3-diazaspiro[4.5]decan-4-one
PubChem CID136734054
Molecular FormulaC15H25N3O
Molecular Weight263.38 g/mol
Exact Mass263.20
IUPAC Name2-cyclopropylimino-7-(2-methylpropyl)-1,3-diazaspiro[4.5]decan-4-one
SMILESCC(C)CC1CCCC2(C1)N/C(=N/C1CC1)NC2=O
InChIInChI=1S/C15H25N3O/c1-10(2)8-11-4-3-7-15(9-11)13(19)17-14(18-15)16-12-5-6-12/h10-12H,3-9H2,1-2H3,(H2,16,17,18,19)
InChIKeyUZJBMKUTVZKNBZ-UHFFFAOYSA-N
XLogP2.20
TPSA53.49 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.38
LogP ≤ 52.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-cyclopropylimino-7-(2-methylpropyl)-1,3-diazaspiro[4.5]decan-4-one?
The IUPAC name of 2-cyclopropylimino-7-(2-methylpropyl)-1,3-diazaspiro[4.5]decan-4-one (CID 136734054) is 2-cyclopropylimino-7-(2-methylpropyl)-1,3-diazaspiro[4.5]decan-4-one.
What is the SMILES notation for 2-cyclopropylimino-7-(2-methylpropyl)-1,3-diazaspiro[4.5]decan-4-one?
The canonical SMILES for 2-cyclopropylimino-7-(2-methylpropyl)-1,3-diazaspiro[4.5]decan-4-one is CC(C)CC1CCCC2(C1)N/C(=N/C1CC1)NC2=O.
What is the InChIKey of 2-cyclopropylimino-7-(2-methylpropyl)-1,3-diazaspiro[4.5]decan-4-one?
The InChIKey is UZJBMKUTVZKNBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3O/c1-10(2)8-11-4-3-7-15(9-11)13(19)17-14(18-15)16-12-5-6-12/h10-12H,3-9H2,1-2H3,(H2,16,17,18,19).
What are the key properties of 2-cyclopropylimino-7-(2-methylpropyl)-1,3-diazaspiro[4.5]decan-4-one?
2-cyclopropylimino-7-(2-methylpropyl)-1,3-diazaspiro[4.5]decan-4-one has a molecular weight of 263.38 g/mol, XLogP of 2.20, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropylimino-7-(2-methylpropyl)-1,3-diazaspiro[4.5]decan-4-one is sourced from PubChem (CID 136734054), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).