1',5-dimethyl-4'-methylidenespiro[1,3-dihydroindene-2,5'-imidazolidine]-2'-one

C14H16N2O — CID 145495573

IUPAC1',5-dimethyl-4'-methylidenespiro[1,3-dihydroindene-2,5'-imidazolidine]-2'-one
SMILESC=C1NC(=O)N(C)C12Cc1ccc(C)cc1C2
InChIInChI=1S/C14H16N2O/c1-9-4-5-11-7-14(8-12(11)6-9)10(2)15-13(17)16(14)3/h4-6H,2,7-8H2,1,3H3,(H,15,17)
InChIKeySXAKDMQGBVJNRM-UHFFFAOYSA-N
MW228.29 g/mol
LogP2.00
Rot. Bonds

About 1',5-dimethyl-4'-methylidenespiro[1,3-dihydroindene-2,5'-imidazolidine]-2'-one

1',5-dimethyl-4'-methylidenespiro[1,3-dihydroindene-2,5'-imidazolidine]-2'-one (PubChem CID 145495573) has the molecular formula C14H16N2O and a molecular weight of 228.29 g/mol. Its IUPAC name is 1',5-dimethyl-4'-methylidenespiro[1,3-dihydroindene-2,5'-imidazolidine]-2'-one.

Molecular Properties

Compound Name1',5-dimethyl-4'-methylidenespiro[1,3-dihydroindene-2,5'-imidazolidine]-2'-one
PubChem CID145495573
Molecular FormulaC14H16N2O
Molecular Weight228.29 g/mol
Exact Mass228.13
IUPAC Name1',5-dimethyl-4'-methylidenespiro[1,3-dihydroindene-2,5'-imidazolidine]-2'-one
SMILESC=C1NC(=O)N(C)C12Cc1ccc(C)cc1C2
InChIInChI=1S/C14H16N2O/c1-9-4-5-11-7-14(8-12(11)6-9)10(2)15-13(17)16(14)3/h4-6H,2,7-8H2,1,3H3,(H,15,17)
InChIKeySXAKDMQGBVJNRM-UHFFFAOYSA-N
XLogP2.00
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.29
LogP ≤ 52.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1',5-dimethyl-4'-methylidenespiro[1,3-dihydroindene-2,5'-imidazolidine]-2'-one?
The IUPAC name of 1',5-dimethyl-4'-methylidenespiro[1,3-dihydroindene-2,5'-imidazolidine]-2'-one (CID 145495573) is 1',5-dimethyl-4'-methylidenespiro[1,3-dihydroindene-2,5'-imidazolidine]-2'-one.
What is the SMILES notation for 1',5-dimethyl-4'-methylidenespiro[1,3-dihydroindene-2,5'-imidazolidine]-2'-one?
The canonical SMILES for 1',5-dimethyl-4'-methylidenespiro[1,3-dihydroindene-2,5'-imidazolidine]-2'-one is C=C1NC(=O)N(C)C12Cc1ccc(C)cc1C2.
What is the InChIKey of 1',5-dimethyl-4'-methylidenespiro[1,3-dihydroindene-2,5'-imidazolidine]-2'-one?
The InChIKey is SXAKDMQGBVJNRM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O/c1-9-4-5-11-7-14(8-12(11)6-9)10(2)15-13(17)16(14)3/h4-6H,2,7-8H2,1,3H3,(H,15,17).
What are the key properties of 1',5-dimethyl-4'-methylidenespiro[1,3-dihydroindene-2,5'-imidazolidine]-2'-one?
1',5-dimethyl-4'-methylidenespiro[1,3-dihydroindene-2,5'-imidazolidine]-2'-one has a molecular weight of 228.29 g/mol, XLogP of 2.00, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1',5-dimethyl-4'-methylidenespiro[1,3-dihydroindene-2,5'-imidazolidine]-2'-one is sourced from PubChem (CID 145495573), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).