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

C24H27N3O3 — CID 46235145

IUPAC1-[[4-[2-(morpholin-4-ylmethyl)phenyl]phenyl]methyl]-3-prop-2-enylimidazolidine-2,4-dione
SMILESC=CCN1C(=O)CN(Cc2ccc(-c3ccccc3CN3CCOCC3)cc2)C1=O
InChIInChI=1S/C24H27N3O3/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/h2-10H,1,11-18H2
InChIKeyFODNRQJQMUVRQF-UHFFFAOYSA-N
MW405.50 g/mol
LogP3.14
Rot. Bonds7

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

1-[[4-[2-(morpholin-4-ylmethyl)phenyl]phenyl]methyl]-3-prop-2-enylimidazolidine-2,4-dione (PubChem CID 46235145) has the molecular formula C24H27N3O3 and a molecular weight of 405.50 g/mol. Its IUPAC name is 1-[[4-[2-(morpholin-4-ylmethyl)phenyl]phenyl]methyl]-3-prop-2-enylimidazolidine-2,4-dione.

Molecular Properties

Compound Name1-[[4-[2-(morpholin-4-ylmethyl)phenyl]phenyl]methyl]-3-prop-2-enylimidazolidine-2,4-dione
PubChem CID46235145
Molecular FormulaC24H27N3O3
Molecular Weight405.50 g/mol
Exact Mass405.21
IUPAC Name1-[[4-[2-(morpholin-4-ylmethyl)phenyl]phenyl]methyl]-3-prop-2-enylimidazolidine-2,4-dione
SMILESC=CCN1C(=O)CN(Cc2ccc(-c3ccccc3CN3CCOCC3)cc2)C1=O
InChIInChI=1S/C24H27N3O3/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/h2-10H,1,11-18H2
InChIKeyFODNRQJQMUVRQF-UHFFFAOYSA-N
XLogP3.14
TPSA53.09 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500405.50
LogP ≤ 53.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

1-[[4-[2-(morpholin-4-ylmethyl)phenyl]phenyl]methyl]-3-propylimidazolidine-2,4-dione
CID 46234990
4-[[2-[4-[[3-(2-fluoroethyl)imidazolidin-1-yl]methyl]phenyl]phenyl]methyl]morpholine
CID 91325196
N-(2-chloroethyl)-4-[2-(morpholin-4-ylmethyl)phenyl]benzenesulfonamide
CID 162435337
methyl 2-[carbamoyl-[[4-[2-(morpholin-4-ylmethyl)phenyl]phenyl]methyl]amino]acetate
CID 67240862
4-[[4-[4-(piperidin-1-ylmethyl)phenyl]phenyl]methyl]morpholine
CID 44588214
N-[[2-[4-[(2-oxopyrrolidin-1-yl)methyl]phenyl]phenyl]methyl]ethenesulfonamide
CID 167821614
N-[(1R)-1-[4-[2-(morpholin-4-ylmethyl)phenyl]phenyl]ethyl]acetamide
CID 97455580
4-[[2-(3H-benzimidazol-5-yl)phenyl]methyl]morpholine
CID 29185404
4-[[2-(1,3-dihydroisoindol-2-ylmethyl)phenyl]methyl]morpholine
CID 13041711
3-[[4-[2-[(4-methylpiperazin-1-yl)methyl]phenyl]phenyl]methyl]-1-oxa-3-azaspiro[4.5]decan-2-one
CID 24985420
(5R)-5-(4-chlorophenyl)-3-[[4-[2-(piperazin-1-ylmethyl)phenyl]phenyl]methyl]-1,3-oxazolidin-2-one
CID 59515473
[2-[4-(piperidin-1-ylmethyl)phenyl]phenyl]methanamine
CID 16793650

Frequently Asked Questions

What is the IUPAC name of 1-[[4-[2-(morpholin-4-ylmethyl)phenyl]phenyl]methyl]-3-prop-2-enylimidazolidine-2,4-dione?
The IUPAC name of 1-[[4-[2-(morpholin-4-ylmethyl)phenyl]phenyl]methyl]-3-prop-2-enylimidazolidine-2,4-dione (CID 46235145) is 1-[[4-[2-(morpholin-4-ylmethyl)phenyl]phenyl]methyl]-3-prop-2-enylimidazolidine-2,4-dione.
What is the SMILES notation for 1-[[4-[2-(morpholin-4-ylmethyl)phenyl]phenyl]methyl]-3-prop-2-enylimidazolidine-2,4-dione?
The canonical SMILES for 1-[[4-[2-(morpholin-4-ylmethyl)phenyl]phenyl]methyl]-3-prop-2-enylimidazolidine-2,4-dione is C=CCN1C(=O)CN(Cc2ccc(-c3ccccc3CN3CCOCC3)cc2)C1=O.
What is the InChIKey of 1-[[4-[2-(morpholin-4-ylmethyl)phenyl]phenyl]methyl]-3-prop-2-enylimidazolidine-2,4-dione?
The InChIKey is FODNRQJQMUVRQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H27N3O3/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/h2-10H,1,11-18H2.
What are the key properties of 1-[[4-[2-(morpholin-4-ylmethyl)phenyl]phenyl]methyl]-3-prop-2-enylimidazolidine-2,4-dione?
1-[[4-[2-(morpholin-4-ylmethyl)phenyl]phenyl]methyl]-3-prop-2-enylimidazolidine-2,4-dione has a molecular weight of 405.50 g/mol, XLogP of 3.14, 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-prop-2-enylimidazolidine-2,4-dione is sourced from PubChem (CID 46235145), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).