N-[2-(N,2-dimethylanilino)ethyl]-3-(2,5-dioxo-4-phenylimidazolidin-4-yl)-N-ethylpropanamide

C24H30N4O3 — CID 146266006

IUPACN-[2-(N,2-dimethylanilino)ethyl]-3-(2,5-dioxo-4-phenylimidazolidin-4-yl)-N-ethylpropanamide
SMILESCCN(CCN(C)c1ccccc1C)C(=O)CCC1(c2ccccc2)NC(=O)NC1=O
InChIInChI=1S/C24H30N4O3/c1-4-28(17-16-27(3)20-13-9-8-10-18(20)2)21(29)14-15-24(19-11-6-5-7-12-19)22(30)25-23(31)26-24/h5-13H,4,14-17H2,1-3H3,(H2,25,26,30,31)
InChIKeyUUNUVUQIOBMOEQ-UHFFFAOYSA-N
MW422.53 g/mol
LogP2.79
Rot. Bonds9

About N-[2-(N,2-dimethylanilino)ethyl]-3-(2,5-dioxo-4-phenylimidazolidin-4-yl)-N-ethylpropanamide

N-[2-(N,2-dimethylanilino)ethyl]-3-(2,5-dioxo-4-phenylimidazolidin-4-yl)-N-ethylpropanamide (PubChem CID 146266006) has the molecular formula C24H30N4O3 and a molecular weight of 422.53 g/mol. Its IUPAC name is N-[2-(N,2-dimethylanilino)ethyl]-3-(2,5-dioxo-4-phenylimidazolidin-4-yl)-N-ethylpropanamide.

Molecular Properties

Compound NameN-[2-(N,2-dimethylanilino)ethyl]-3-(2,5-dioxo-4-phenylimidazolidin-4-yl)-N-ethylpropanamide
PubChem CID146266006
Molecular FormulaC24H30N4O3
Molecular Weight422.53 g/mol
Exact Mass422.23
IUPAC NameN-[2-(N,2-dimethylanilino)ethyl]-3-(2,5-dioxo-4-phenylimidazolidin-4-yl)-N-ethylpropanamide
SMILESCCN(CCN(C)c1ccccc1C)C(=O)CCC1(c2ccccc2)NC(=O)NC1=O
InChIInChI=1S/C24H30N4O3/c1-4-28(17-16-27(3)20-13-9-8-10-18(20)2)21(29)14-15-24(19-11-6-5-7-12-19)22(30)25-23(31)26-24/h5-13H,4,14-17H2,1-3H3,(H2,25,26,30,31)
InChIKeyUUNUVUQIOBMOEQ-UHFFFAOYSA-N
XLogP2.79
TPSA81.75 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500422.53
LogP ≤ 52.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

3-(2,5-dioxo-4-phenylimidazolidin-4-yl)-N-ethyl-N-phenylpropanamide
CID 110677266
3-(4-tert-butyl-2,5-dioxoimidazolidin-4-yl)-N-[2-(5-chloro-N,2-dimethylanilino)ethyl]-N-ethylpropanamide
CID 146266024
[2-[2-(N,2-dimethylanilino)ethyl-ethylamino]-2-oxoethyl] acetate
CID 68690838
3-(2,5-dioxo-4-phenylimidazolidin-4-yl)-N-(4-methylphenyl)propanamide
CID 110677254
5-[3-(4-acetylpiperazin-1-yl)-3-oxopropyl]-5-phenylimidazolidine-2,4-dione
CID 110677215
5-[3-(azepan-1-yl)-3-oxopropyl]-5-phenylimidazolidine-2,4-dione
CID 110677250
6-(N,2-dimethylanilino)hexan-3-one
CID 106801284
N,2-dimethyl-N-propylaniline
CID 69435269
3-[[2-(N-ethyl-2-methylanilino)-2-oxoethyl]-methylamino]propanoic acid
CID 60987713
hexanoic acid;methyl-(2-methylphenyl)carbamic acid
CID 174982557
3-[N-[2-(dimethylamino)ethyl]-2-methylanilino]propanoic acid
CID 60839076
7-(N,2-dimethylanilino)-7-oxoheptanoic acid
CID 59823939

Frequently Asked Questions

What is the IUPAC name of N-[2-(N,2-dimethylanilino)ethyl]-3-(2,5-dioxo-4-phenylimidazolidin-4-yl)-N-ethylpropanamide?
The IUPAC name of N-[2-(N,2-dimethylanilino)ethyl]-3-(2,5-dioxo-4-phenylimidazolidin-4-yl)-N-ethylpropanamide (CID 146266006) is N-[2-(N,2-dimethylanilino)ethyl]-3-(2,5-dioxo-4-phenylimidazolidin-4-yl)-N-ethylpropanamide.
What is the SMILES notation for N-[2-(N,2-dimethylanilino)ethyl]-3-(2,5-dioxo-4-phenylimidazolidin-4-yl)-N-ethylpropanamide?
The canonical SMILES for N-[2-(N,2-dimethylanilino)ethyl]-3-(2,5-dioxo-4-phenylimidazolidin-4-yl)-N-ethylpropanamide is CCN(CCN(C)c1ccccc1C)C(=O)CCC1(c2ccccc2)NC(=O)NC1=O.
What is the InChIKey of N-[2-(N,2-dimethylanilino)ethyl]-3-(2,5-dioxo-4-phenylimidazolidin-4-yl)-N-ethylpropanamide?
The InChIKey is UUNUVUQIOBMOEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H30N4O3/c1-4-28(17-16-27(3)20-13-9-8-10-18(20)2)21(29)14-15-24(19-11-6-5-7-12-19)22(30)25-23(31)26-24/h5-13H,4,14-17H2,1-3H3,(H2,25,26,30,31).
What are the key properties of N-[2-(N,2-dimethylanilino)ethyl]-3-(2,5-dioxo-4-phenylimidazolidin-4-yl)-N-ethylpropanamide?
N-[2-(N,2-dimethylanilino)ethyl]-3-(2,5-dioxo-4-phenylimidazolidin-4-yl)-N-ethylpropanamide has a molecular weight of 422.53 g/mol, XLogP of 2.79, 9 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(N,2-dimethylanilino)ethyl]-3-(2,5-dioxo-4-phenylimidazolidin-4-yl)-N-ethylpropanamide is sourced from PubChem (CID 146266006), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).