3-(2-methyl-2-phenylpropyl)-1-[(2-methyl-4-pyridinyl)methyl]imidazolidine-2,4-dione

C20H23N3O2 — CID 167776939

IUPAC3-(2-methyl-2-phenylpropyl)-1-[(2-methyl-4-pyridinyl)methyl]imidazolidine-2,4-dione
SMILESCc1cc(CN2CC(=O)N(CC(C)(C)c3ccccc3)C2=O)ccn1
InChIInChI=1S/C20H23N3O2/c1-15-11-16(9-10-21-15)12-22-13-18(24)23(19(22)25)14-20(2,3)17-7-5-4-6-8-17/h4-11H,12-14H2,1-3H3
InChIKeyISMGMOKEYXGTPA-UHFFFAOYSA-N
MW337.42 g/mol
LogP3.13
Rot. Bonds5

About 3-(2-methyl-2-phenylpropyl)-1-[(2-methyl-4-pyridinyl)methyl]imidazolidine-2,4-dione

3-(2-methyl-2-phenylpropyl)-1-[(2-methyl-4-pyridinyl)methyl]imidazolidine-2,4-dione (PubChem CID 167776939) has the molecular formula C20H23N3O2 and a molecular weight of 337.42 g/mol. Its IUPAC name is 3-(2-methyl-2-phenylpropyl)-1-[(2-methyl-4-pyridinyl)methyl]imidazolidine-2,4-dione.

Molecular Properties

Compound Name3-(2-methyl-2-phenylpropyl)-1-[(2-methyl-4-pyridinyl)methyl]imidazolidine-2,4-dione
PubChem CID167776939
Molecular FormulaC20H23N3O2
Molecular Weight337.42 g/mol
Exact Mass337.18
IUPAC Name3-(2-methyl-2-phenylpropyl)-1-[(2-methyl-4-pyridinyl)methyl]imidazolidine-2,4-dione
SMILESCc1cc(CN2CC(=O)N(CC(C)(C)c3ccccc3)C2=O)ccn1
InChIInChI=1S/C20H23N3O2/c1-15-11-16(9-10-21-15)12-22-13-18(24)23(19(22)25)14-20(2,3)17-7-5-4-6-8-17/h4-11H,12-14H2,1-3H3
InChIKeyISMGMOKEYXGTPA-UHFFFAOYSA-N
XLogP3.13
TPSA53.51 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.42
LogP ≤ 53.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 3-(2-methyl-2-phenylpropyl)-1-[(2-methyl-4-pyridinyl)methyl]imidazolidine-2,4-dione?
The IUPAC name of 3-(2-methyl-2-phenylpropyl)-1-[(2-methyl-4-pyridinyl)methyl]imidazolidine-2,4-dione (CID 167776939) is 3-(2-methyl-2-phenylpropyl)-1-[(2-methyl-4-pyridinyl)methyl]imidazolidine-2,4-dione.
What is the SMILES notation for 3-(2-methyl-2-phenylpropyl)-1-[(2-methyl-4-pyridinyl)methyl]imidazolidine-2,4-dione?
The canonical SMILES for 3-(2-methyl-2-phenylpropyl)-1-[(2-methyl-4-pyridinyl)methyl]imidazolidine-2,4-dione is Cc1cc(CN2CC(=O)N(CC(C)(C)c3ccccc3)C2=O)ccn1.
What is the InChIKey of 3-(2-methyl-2-phenylpropyl)-1-[(2-methyl-4-pyridinyl)methyl]imidazolidine-2,4-dione?
The InChIKey is ISMGMOKEYXGTPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23N3O2/c1-15-11-16(9-10-21-15)12-22-13-18(24)23(19(22)25)14-20(2,3)17-7-5-4-6-8-17/h4-11H,12-14H2,1-3H3.
What are the key properties of 3-(2-methyl-2-phenylpropyl)-1-[(2-methyl-4-pyridinyl)methyl]imidazolidine-2,4-dione?
3-(2-methyl-2-phenylpropyl)-1-[(2-methyl-4-pyridinyl)methyl]imidazolidine-2,4-dione has a molecular weight of 337.42 g/mol, XLogP of 3.13, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-methyl-2-phenylpropyl)-1-[(2-methyl-4-pyridinyl)methyl]imidazolidine-2,4-dione is sourced from PubChem (CID 167776939), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).