(8-methyl-4-phenyl-1,2-diazaspiro[4.5]dec-2-en-3-yl)-phenylmethanone

C22H24N2O — CID 135026260

IUPAC(8-methyl-4-phenyl-1,2-diazaspiro[4.5]dec-2-en-3-yl)-phenylmethanone
SMILESCC1CCC2(CC1)NN=C(C(=O)c1ccccc1)C2c1ccccc1
InChIInChI=1S/C22H24N2O/c1-16-12-14-22(15-13-16)19(17-8-4-2-5-9-17)20(23-24-22)21(25)18-10-6-3-7-11-18/h2-11,16,19,24H,12-15H2,1H3
InChIKeyUJCPBBLBRDMYHU-UHFFFAOYSA-N
MW332.45 g/mol
LogP4.56
Rot. Bonds3

About (8-methyl-4-phenyl-1,2-diazaspiro[4.5]dec-2-en-3-yl)-phenylmethanone

(8-methyl-4-phenyl-1,2-diazaspiro[4.5]dec-2-en-3-yl)-phenylmethanone (PubChem CID 135026260) has the molecular formula C22H24N2O and a molecular weight of 332.45 g/mol. Its IUPAC name is (8-methyl-4-phenyl-1,2-diazaspiro[4.5]dec-2-en-3-yl)-phenylmethanone.

Molecular Properties

Compound Name(8-methyl-4-phenyl-1,2-diazaspiro[4.5]dec-2-en-3-yl)-phenylmethanone
PubChem CID135026260
Molecular FormulaC22H24N2O
Molecular Weight332.45 g/mol
Exact Mass332.19
IUPAC Name(8-methyl-4-phenyl-1,2-diazaspiro[4.5]dec-2-en-3-yl)-phenylmethanone
SMILESCC1CCC2(CC1)NN=C(C(=O)c1ccccc1)C2c1ccccc1
InChIInChI=1S/C22H24N2O/c1-16-12-14-22(15-13-16)19(17-8-4-2-5-9-17)20(23-24-22)21(25)18-10-6-3-7-11-18/h2-11,16,19,24H,12-15H2,1H3
InChIKeyUJCPBBLBRDMYHU-UHFFFAOYSA-N
XLogP4.56
TPSA41.46 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.45
LogP ≤ 54.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (8-methyl-4-phenyl-1,2-diazaspiro[4.5]dec-2-en-3-yl)-phenylmethanone?
The IUPAC name of (8-methyl-4-phenyl-1,2-diazaspiro[4.5]dec-2-en-3-yl)-phenylmethanone (CID 135026260) is (8-methyl-4-phenyl-1,2-diazaspiro[4.5]dec-2-en-3-yl)-phenylmethanone.
What is the SMILES notation for (8-methyl-4-phenyl-1,2-diazaspiro[4.5]dec-2-en-3-yl)-phenylmethanone?
The canonical SMILES for (8-methyl-4-phenyl-1,2-diazaspiro[4.5]dec-2-en-3-yl)-phenylmethanone is CC1CCC2(CC1)NN=C(C(=O)c1ccccc1)C2c1ccccc1.
What is the InChIKey of (8-methyl-4-phenyl-1,2-diazaspiro[4.5]dec-2-en-3-yl)-phenylmethanone?
The InChIKey is UJCPBBLBRDMYHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H24N2O/c1-16-12-14-22(15-13-16)19(17-8-4-2-5-9-17)20(23-24-22)21(25)18-10-6-3-7-11-18/h2-11,16,19,24H,12-15H2,1H3.
What are the key properties of (8-methyl-4-phenyl-1,2-diazaspiro[4.5]dec-2-en-3-yl)-phenylmethanone?
(8-methyl-4-phenyl-1,2-diazaspiro[4.5]dec-2-en-3-yl)-phenylmethanone has a molecular weight of 332.45 g/mol, XLogP of 4.56, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (8-methyl-4-phenyl-1,2-diazaspiro[4.5]dec-2-en-3-yl)-phenylmethanone is sourced from PubChem (CID 135026260), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).