4-(2,4-dioxoimidazolidin-1-yl)-N-[(2R)-1-pyridin-3-ylpropan-2-yl]benzamide

C18H18N4O3 — CID 97203237

IUPAC4-(2,4-dioxoimidazolidin-1-yl)-N-[(2R)-1-pyridin-3-ylpropan-2-yl]benzamide
SMILESC[C@H](Cc1cccnc1)NC(=O)c1ccc(N2CC(=O)NC2=O)cc1
InChIInChI=1S/C18H18N4O3/c1-12(9-13-3-2-8-19-10-13)20-17(24)14-4-6-15(7-5-14)22-11-16(23)21-18(22)25/h2-8,10,12H,9,11H2,1H3,(H,20,24)(H,21,23,25)/t12-/m1/s1
InChIKeyHUBUMIDPMDVIAV-GFCCVEGCSA-N
MW338.37 g/mol
LogP1.50
Rot. Bonds5

About 4-(2,4-dioxoimidazolidin-1-yl)-N-[(2R)-1-pyridin-3-ylpropan-2-yl]benzamide

4-(2,4-dioxoimidazolidin-1-yl)-N-[(2R)-1-pyridin-3-ylpropan-2-yl]benzamide (PubChem CID 97203237) has the molecular formula C18H18N4O3 and a molecular weight of 338.37 g/mol. Its IUPAC name is 4-(2,4-dioxoimidazolidin-1-yl)-N-[(2R)-1-pyridin-3-ylpropan-2-yl]benzamide.

Molecular Properties

Compound Name4-(2,4-dioxoimidazolidin-1-yl)-N-[(2R)-1-pyridin-3-ylpropan-2-yl]benzamide
PubChem CID97203237
Molecular FormulaC18H18N4O3
Molecular Weight338.37 g/mol
Exact Mass338.14
IUPAC Name4-(2,4-dioxoimidazolidin-1-yl)-N-[(2R)-1-pyridin-3-ylpropan-2-yl]benzamide
SMILESC[C@H](Cc1cccnc1)NC(=O)c1ccc(N2CC(=O)NC2=O)cc1
InChIInChI=1S/C18H18N4O3/c1-12(9-13-3-2-8-19-10-13)20-17(24)14-4-6-15(7-5-14)22-11-16(23)21-18(22)25/h2-8,10,12H,9,11H2,1H3,(H,20,24)(H,21,23,25)/t12-/m1/s1
InChIKeyHUBUMIDPMDVIAV-GFCCVEGCSA-N
XLogP1.50
TPSA91.40 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.37
LogP ≤ 51.50
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

4-[1-(cyclopropylmethyl)pyrazol-4-yl]-N-(1-pyridin-3-ylpropan-2-yl)benzamide
CID 122570086
4-(2,4-dioxoimidazolidin-1-yl)-N-[(S)-(2-methylphenyl)-pyridin-4-ylmethyl]benzamide
CID 97187022
2-ethyl-N-(1-pyridin-3-ylpropan-2-yl)pyridine-4-carboxamide
CID 90653792
4-[5-[(dimethylamino)methyl]-2-pyridinyl]-N-[(2R)-1-pyridin-3-ylpropan-2-yl]benzamide
CID 125440095
2-propan-2-yl-N-[(2S)-1-pyridin-3-ylpropan-2-yl]pyrazole-3-carboxamide
CID 126443700
N-[(2R)-1-(4-bromophenyl)propan-2-yl]pyridine-3-carboxamide
CID 51948817
N-[(S)-cyclopropyl-(2-ethyl-1,2,4-triazol-3-yl)methyl]-4-(2,4-dioxoimidazolidin-1-yl)benzamide
CID 125161407
4-(2,4-dioxoimidazolidin-1-yl)-N-[(5-methylpyrazin-2-yl)methyl]benzamide
CID 74231577
4-(2,4-dioxoimidazolidin-1-yl)-N-[2-(5-propan-2-yl-1,2,4-oxadiazol-3-yl)ethyl]benzamide
CID 118764526
2-methylsulfanyl-N-[(2S)-1-pyridin-3-ylpropan-2-yl]pyridine-3-carboxamide
CID 99927418
N-[1-(2,6-difluorophenyl)propan-2-yl]-4-(pyridin-3-ylmethylsulfanyl)benzamide
CID 55877942
N-ethyl-3-methyl-4-[[(2S)-1-pyridin-3-ylpropan-2-yl]carbamoylamino]benzamide
CID 125177536

Frequently Asked Questions

What is the IUPAC name of 4-(2,4-dioxoimidazolidin-1-yl)-N-[(2R)-1-pyridin-3-ylpropan-2-yl]benzamide?
The IUPAC name of 4-(2,4-dioxoimidazolidin-1-yl)-N-[(2R)-1-pyridin-3-ylpropan-2-yl]benzamide (CID 97203237) is 4-(2,4-dioxoimidazolidin-1-yl)-N-[(2R)-1-pyridin-3-ylpropan-2-yl]benzamide.
What is the SMILES notation for 4-(2,4-dioxoimidazolidin-1-yl)-N-[(2R)-1-pyridin-3-ylpropan-2-yl]benzamide?
The canonical SMILES for 4-(2,4-dioxoimidazolidin-1-yl)-N-[(2R)-1-pyridin-3-ylpropan-2-yl]benzamide is C[C@H](Cc1cccnc1)NC(=O)c1ccc(N2CC(=O)NC2=O)cc1.
What is the InChIKey of 4-(2,4-dioxoimidazolidin-1-yl)-N-[(2R)-1-pyridin-3-ylpropan-2-yl]benzamide?
The InChIKey is HUBUMIDPMDVIAV-GFCCVEGCSA-N. The full InChI is InChI=1S/C18H18N4O3/c1-12(9-13-3-2-8-19-10-13)20-17(24)14-4-6-15(7-5-14)22-11-16(23)21-18(22)25/h2-8,10,12H,9,11H2,1H3,(H,20,24)(H,21,23,25)/t12-/m1/s1.
What are the key properties of 4-(2,4-dioxoimidazolidin-1-yl)-N-[(2R)-1-pyridin-3-ylpropan-2-yl]benzamide?
4-(2,4-dioxoimidazolidin-1-yl)-N-[(2R)-1-pyridin-3-ylpropan-2-yl]benzamide has a molecular weight of 338.37 g/mol, XLogP of 1.50, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2,4-dioxoimidazolidin-1-yl)-N-[(2R)-1-pyridin-3-ylpropan-2-yl]benzamide is sourced from PubChem (CID 97203237), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).