(2R)-N-(4-chlorophenyl)-2-[(4R)-2,5-dioxo-4-propylimidazolidin-1-yl]propanamide

C15H18ClN3O3 — CID 9264854

IUPAC(2R)-N-(4-chlorophenyl)-2-[(4R)-2,5-dioxo-4-propylimidazolidin-1-yl]propanamide
SMILESCCC[C@H]1NC(=O)N([C@H](C)C(=O)Nc2ccc(Cl)cc2)C1=O
InChIInChI=1S/C15H18ClN3O3/c1-3-4-12-14(21)19(15(22)18-12)9(2)13(20)17-11-7-5-10(16)6-8-11/h5-9,12H,3-4H2,1-2H3,(H,17,20)(H,18,22)/t9-,12-/m1/s1
InChIKeyLTZNWWADXRBLEN-BXKDBHETSA-N
MW323.78 g/mol
LogP2.39
Rot. Bonds5

About (2R)-N-(4-chlorophenyl)-2-[(4R)-2,5-dioxo-4-propylimidazolidin-1-yl]propanamide

(2R)-N-(4-chlorophenyl)-2-[(4R)-2,5-dioxo-4-propylimidazolidin-1-yl]propanamide (PubChem CID 9264854) has the molecular formula C15H18ClN3O3 and a molecular weight of 323.78 g/mol. Its IUPAC name is (2R)-N-(4-chlorophenyl)-2-[(4R)-2,5-dioxo-4-propylimidazolidin-1-yl]propanamide.

Molecular Properties

Compound Name(2R)-N-(4-chlorophenyl)-2-[(4R)-2,5-dioxo-4-propylimidazolidin-1-yl]propanamide
PubChem CID9264854
Molecular FormulaC15H18ClN3O3
Molecular Weight323.78 g/mol
Exact Mass323.10
IUPAC Name(2R)-N-(4-chlorophenyl)-2-[(4R)-2,5-dioxo-4-propylimidazolidin-1-yl]propanamide
SMILESCCC[C@H]1NC(=O)N([C@H](C)C(=O)Nc2ccc(Cl)cc2)C1=O
InChIInChI=1S/C15H18ClN3O3/c1-3-4-12-14(21)19(15(22)18-12)9(2)13(20)17-11-7-5-10(16)6-8-11/h5-9,12H,3-4H2,1-2H3,(H,17,20)(H,18,22)/t9-,12-/m1/s1
InChIKeyLTZNWWADXRBLEN-BXKDBHETSA-N
XLogP2.39
TPSA78.51 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.78
LogP ≤ 52.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

(2R)-2-[(4R)-2,5-dioxo-4-propylimidazolidin-1-yl]-N-(4-morpholin-4-ylphenyl)propanamide
CID 41037007
N-(4-chlorophenyl)-2-(1,3-dioxo-3a,4,5,6,7,7a-hexahydroisoindol-2-yl)propanamide
CID 86932275
(2S)-2-[(3aR,7aR)-1,3-dioxo-3a,4,7,7a-tetrahydroisoindol-2-yl]-N-(4-chlorophenyl)propanamide
CID 7610663
N-(4-chlorophenyl)-2-(3,5-dioxo-4-azatricyclo[5.2.1.02,6]dec-8-en-4-yl)propanamide
CID 18851892
(2R)-N-(4-chlorophenyl)-2-[(1S,2R,6S,7S,8R,10R)-3,5-dioxo-4-azatetracyclo[5.3.2.02,6.08,10]dodec-11-en-4-yl]propanamide
CID 124722243
1-[1-(4-chloroanilino)-1-oxopropan-2-yl]-N-propylpiperidine-4-carboxamide
CID 51112690
(2S)-N-(3-chlorophenyl)-2-[(4S)-4-(1H-indol-3-ylmethyl)-2,5-dioxoimidazolidin-1-yl]propanamide
CID 7917393
2-(6-amino-2-ethyl-3-oxopyrido[3,2-b][1,4]oxazin-4-yl)-N-(4-chlorophenyl)propanamide
CID 110831649
N-(4-chlorophenyl)-2-hydroxy-3-methylbutanamide
CID 117059282
(2R)-N-(4-chlorophenyl)-2-[(3R,5S)-3,5-dimethylpiperidin-1-yl]propanamide
CID 98319058
[(2R)-1-(4-chloroanilino)-1-oxopropan-2-yl] (2S)-2-[(3aS,7aR)-1,3-dioxo-3a,4,5,6,7,7a-hexahydroisoindol-2-yl]propanoate
CID 7572772
N-(4-chlorophenyl)-2-(6-oxopyridazin-1-yl)propanamide
CID 121079706

Frequently Asked Questions

What is the IUPAC name of (2R)-N-(4-chlorophenyl)-2-[(4R)-2,5-dioxo-4-propylimidazolidin-1-yl]propanamide?
The IUPAC name of (2R)-N-(4-chlorophenyl)-2-[(4R)-2,5-dioxo-4-propylimidazolidin-1-yl]propanamide (CID 9264854) is (2R)-N-(4-chlorophenyl)-2-[(4R)-2,5-dioxo-4-propylimidazolidin-1-yl]propanamide.
What is the SMILES notation for (2R)-N-(4-chlorophenyl)-2-[(4R)-2,5-dioxo-4-propylimidazolidin-1-yl]propanamide?
The canonical SMILES for (2R)-N-(4-chlorophenyl)-2-[(4R)-2,5-dioxo-4-propylimidazolidin-1-yl]propanamide is CCC[C@H]1NC(=O)N([C@H](C)C(=O)Nc2ccc(Cl)cc2)C1=O.
What is the InChIKey of (2R)-N-(4-chlorophenyl)-2-[(4R)-2,5-dioxo-4-propylimidazolidin-1-yl]propanamide?
The InChIKey is LTZNWWADXRBLEN-BXKDBHETSA-N. The full InChI is InChI=1S/C15H18ClN3O3/c1-3-4-12-14(21)19(15(22)18-12)9(2)13(20)17-11-7-5-10(16)6-8-11/h5-9,12H,3-4H2,1-2H3,(H,17,20)(H,18,22)/t9-,12-/m1/s1.
What are the key properties of (2R)-N-(4-chlorophenyl)-2-[(4R)-2,5-dioxo-4-propylimidazolidin-1-yl]propanamide?
(2R)-N-(4-chlorophenyl)-2-[(4R)-2,5-dioxo-4-propylimidazolidin-1-yl]propanamide has a molecular weight of 323.78 g/mol, XLogP of 2.39, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-(4-chlorophenyl)-2-[(4R)-2,5-dioxo-4-propylimidazolidin-1-yl]propanamide is sourced from PubChem (CID 9264854), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).