1-[[4-[2-(morpholin-4-ylmethyl)phenyl]phenyl]methyl]-3-propylimidazolidine-2,4-dione

C24H29N3O3 — CID 46234990

IUPAC1-[[4-[2-(morpholin-4-ylmethyl)phenyl]phenyl]methyl]-3-propylimidazolidine-2,4-dione
SMILESCCCN1C(=O)CN(Cc2ccc(-c3ccccc3CN3CCOCC3)cc2)C1=O
InChIInChI=1S/C24H29N3O3/c1-2-11-27-23(28)18-26(24(27)29)16-19-7-9-20(10-8-19)22-6-4-3-5-21(22)17-25-12-14-30-15-13-25/h3-10H,2,11-18H2,1H3
InChIKeyJLHGHNUSKCHVSF-UHFFFAOYSA-N
MW407.51 g/mol
LogP3.36
Rot. Bonds7

About 1-[[4-[2-(morpholin-4-ylmethyl)phenyl]phenyl]methyl]-3-propylimidazolidine-2,4-dione

1-[[4-[2-(morpholin-4-ylmethyl)phenyl]phenyl]methyl]-3-propylimidazolidine-2,4-dione (PubChem CID 46234990) has the molecular formula C24H29N3O3 and a molecular weight of 407.51 g/mol. Its IUPAC name is 1-[[4-[2-(morpholin-4-ylmethyl)phenyl]phenyl]methyl]-3-propylimidazolidine-2,4-dione.

Molecular Properties

Compound Name1-[[4-[2-(morpholin-4-ylmethyl)phenyl]phenyl]methyl]-3-propylimidazolidine-2,4-dione
PubChem CID46234990
Molecular FormulaC24H29N3O3
Molecular Weight407.51 g/mol
Exact Mass407.22
IUPAC Name1-[[4-[2-(morpholin-4-ylmethyl)phenyl]phenyl]methyl]-3-propylimidazolidine-2,4-dione
SMILESCCCN1C(=O)CN(Cc2ccc(-c3ccccc3CN3CCOCC3)cc2)C1=O
InChIInChI=1S/C24H29N3O3/c1-2-11-27-23(28)18-26(24(27)29)16-19-7-9-20(10-8-19)22-6-4-3-5-21(22)17-25-12-14-30-15-13-25/h3-10H,2,11-18H2,1H3
InChIKeyJLHGHNUSKCHVSF-UHFFFAOYSA-N
XLogP3.36
TPSA53.09 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500407.51
LogP ≤ 53.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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-[[4-[2-(morpholin-4-ylmethyl)phenyl]phenyl]methyl]-3-propylimidazolidine-2,4-dione?
The IUPAC name of 1-[[4-[2-(morpholin-4-ylmethyl)phenyl]phenyl]methyl]-3-propylimidazolidine-2,4-dione (CID 46234990) is 1-[[4-[2-(morpholin-4-ylmethyl)phenyl]phenyl]methyl]-3-propylimidazolidine-2,4-dione.
What is the SMILES notation for 1-[[4-[2-(morpholin-4-ylmethyl)phenyl]phenyl]methyl]-3-propylimidazolidine-2,4-dione?
The canonical SMILES for 1-[[4-[2-(morpholin-4-ylmethyl)phenyl]phenyl]methyl]-3-propylimidazolidine-2,4-dione is CCCN1C(=O)CN(Cc2ccc(-c3ccccc3CN3CCOCC3)cc2)C1=O.
What is the InChIKey of 1-[[4-[2-(morpholin-4-ylmethyl)phenyl]phenyl]methyl]-3-propylimidazolidine-2,4-dione?
The InChIKey is JLHGHNUSKCHVSF-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H29N3O3/c1-2-11-27-23(28)18-26(24(27)29)16-19-7-9-20(10-8-19)22-6-4-3-5-21(22)17-25-12-14-30-15-13-25/h3-10H,2,11-18H2,1H3.
What are the key properties of 1-[[4-[2-(morpholin-4-ylmethyl)phenyl]phenyl]methyl]-3-propylimidazolidine-2,4-dione?
1-[[4-[2-(morpholin-4-ylmethyl)phenyl]phenyl]methyl]-3-propylimidazolidine-2,4-dione has a molecular weight of 407.51 g/mol, XLogP of 3.36, 7 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[[4-[2-(morpholin-4-ylmethyl)phenyl]phenyl]methyl]-3-propylimidazolidine-2,4-dione is sourced from PubChem (CID 46234990), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).