1,5,5-trimethyl-3-[[4-[1-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)ethenyl]phenyl]methyl]imidazolidine-2,4-dione

C30H38N2O2 — CID 11408499

IUPAC1,5,5-trimethyl-3-[[4-[1-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)ethenyl]phenyl]methyl]imidazolidine-2,4-dione
SMILESC=C(c1ccc(CN2C(=O)N(C)C(C)(C)C2=O)cc1)c1cc2c(cc1C)C(C)(C)CCC2(C)C
InChIInChI=1S/C30H38N2O2/c1-19-16-24-25(29(5,6)15-14-28(24,3)4)17-23(19)20(2)22-12-10-21(11-13-22)18-32-26(33)30(7,8)31(9)27(32)34/h10-13,16-17H,2,14-15,18H2,1,3-9H3
InChIKeyOLYMDDFAYFLWAD-UHFFFAOYSA-N
MW458.65 g/mol
LogP6.58
Rot. Bonds4

About 1,5,5-trimethyl-3-[[4-[1-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)ethenyl]phenyl]methyl]imidazolidine-2,4-dione

1,5,5-trimethyl-3-[[4-[1-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)ethenyl]phenyl]methyl]imidazolidine-2,4-dione (PubChem CID 11408499) has the molecular formula C30H38N2O2 and a molecular weight of 458.65 g/mol. Its IUPAC name is 1,5,5-trimethyl-3-[[4-[1-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)ethenyl]phenyl]methyl]imidazolidine-2,4-dione.

Molecular Properties

Compound Name1,5,5-trimethyl-3-[[4-[1-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)ethenyl]phenyl]methyl]imidazolidine-2,4-dione
PubChem CID11408499
Molecular FormulaC30H38N2O2
Molecular Weight458.65 g/mol
Exact Mass458.29
IUPAC Name1,5,5-trimethyl-3-[[4-[1-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)ethenyl]phenyl]methyl]imidazolidine-2,4-dione
SMILESC=C(c1ccc(CN2C(=O)N(C)C(C)(C)C2=O)cc1)c1cc2c(cc1C)C(C)(C)CCC2(C)C
InChIInChI=1S/C30H38N2O2/c1-19-16-24-25(29(5,6)15-14-28(24,3)4)17-23(19)20(2)22-12-10-21(11-13-22)18-32-26(33)30(7,8)31(9)27(32)34/h10-13,16-17H,2,14-15,18H2,1,3-9H3
InChIKeyOLYMDDFAYFLWAD-UHFFFAOYSA-N
XLogP6.58
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms34
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500458.65
LogP ≤ 56.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1,5,5-trimethyl-3-[[4-[1-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)ethenyl]phenyl]methyl]imidazolidine-2,4-dione?
The IUPAC name of 1,5,5-trimethyl-3-[[4-[1-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)ethenyl]phenyl]methyl]imidazolidine-2,4-dione (CID 11408499) is 1,5,5-trimethyl-3-[[4-[1-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)ethenyl]phenyl]methyl]imidazolidine-2,4-dione.
What is the SMILES notation for 1,5,5-trimethyl-3-[[4-[1-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)ethenyl]phenyl]methyl]imidazolidine-2,4-dione?
The canonical SMILES for 1,5,5-trimethyl-3-[[4-[1-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)ethenyl]phenyl]methyl]imidazolidine-2,4-dione is C=C(c1ccc(CN2C(=O)N(C)C(C)(C)C2=O)cc1)c1cc2c(cc1C)C(C)(C)CCC2(C)C.
What is the InChIKey of 1,5,5-trimethyl-3-[[4-[1-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)ethenyl]phenyl]methyl]imidazolidine-2,4-dione?
The InChIKey is OLYMDDFAYFLWAD-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H38N2O2/c1-19-16-24-25(29(5,6)15-14-28(24,3)4)17-23(19)20(2)22-12-10-21(11-13-22)18-32-26(33)30(7,8)31(9)27(32)34/h10-13,16-17H,2,14-15,18H2,1,3-9H3.
What are the key properties of 1,5,5-trimethyl-3-[[4-[1-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)ethenyl]phenyl]methyl]imidazolidine-2,4-dione?
1,5,5-trimethyl-3-[[4-[1-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)ethenyl]phenyl]methyl]imidazolidine-2,4-dione has a molecular weight of 458.65 g/mol, XLogP of 6.58, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,5,5-trimethyl-3-[[4-[1-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)ethenyl]phenyl]methyl]imidazolidine-2,4-dione is sourced from PubChem (CID 11408499), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).