2-amino-5,5-diphenyl-3-(4-pyridin-2-ylbutyl)imidazol-4-one

C24H24N4O — CID 44523659

IUPAC2-amino-5,5-diphenyl-3-(4-pyridin-2-ylbutyl)imidazol-4-one
SMILESNC1=NC(c2ccccc2)(c2ccccc2)C(=O)N1CCCCc1ccccn1
InChIInChI=1S/C24H24N4O/c25-23-27-24(19-11-3-1-4-12-19,20-13-5-2-6-14-20)22(29)28(23)18-10-8-16-21-15-7-9-17-26-21/h1-7,9,11-15,17H,8,10,16,18H2,(H2,25,27)
InChIKeyNMFFGVFJFHJARV-UHFFFAOYSA-N
MW384.48 g/mol
LogP3.51
Rot. Bonds7

About 2-amino-5,5-diphenyl-3-(4-pyridin-2-ylbutyl)imidazol-4-one

2-amino-5,5-diphenyl-3-(4-pyridin-2-ylbutyl)imidazol-4-one (PubChem CID 44523659) has the molecular formula C24H24N4O and a molecular weight of 384.48 g/mol. Its IUPAC name is 2-amino-5,5-diphenyl-3-(4-pyridin-2-ylbutyl)imidazol-4-one.

Molecular Properties

Compound Name2-amino-5,5-diphenyl-3-(4-pyridin-2-ylbutyl)imidazol-4-one
PubChem CID44523659
Molecular FormulaC24H24N4O
Molecular Weight384.48 g/mol
Exact Mass384.20
IUPAC Name2-amino-5,5-diphenyl-3-(4-pyridin-2-ylbutyl)imidazol-4-one
SMILESNC1=NC(c2ccccc2)(c2ccccc2)C(=O)N1CCCCc1ccccn1
InChIInChI=1S/C24H24N4O/c25-23-27-24(19-11-3-1-4-12-19,20-13-5-2-6-14-20)22(29)28(23)18-10-8-16-21-15-7-9-17-26-21/h1-7,9,11-15,17H,8,10,16,18H2,(H2,25,27)
InChIKeyNMFFGVFJFHJARV-UHFFFAOYSA-N
XLogP3.51
TPSA71.58 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500384.48
LogP ≤ 53.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

Difenpiramide
CID 100472
N-(5-methylpyridin-2-yl)-2,2-diphenylacetamide
CID 939927
N-[(1r,3s)-3-{[(2e,4r)-4-(2-Cyclohexylethyl)-2-Imino-1-Methyl-5-Oxoimidazolidin-4-Yl]methyl}cyclohexyl]pyridine-4-Carboxamide
CID 11582999
4,4-Diphenyl-N-(pyridin-3-yl)-butyramide
CID 11976417
(5S)-2-amino-5-(2,6-diethylpyridin-4-yl)-3-methyl-5-(3-pyrimidin-5-ylphenyl)-3,5-dihydro-4H-imidazol-4-one
CID 16726085
(5S)-2-amino-5-(2',5'-difluorobiphenyl-3-yl)-3-methyl-5-pyridin-4-yl-3,5-dihydro-4H-imidazol-4-one
CID 46830239
(2e,5r)-5-Cyclopropyl-2-Imino-3-Methyl-5-{3-[5-(Prop-1-Yn-1-Yl)pyridin-3-Yl]phenyl}imidazolidin-4-One
CID 57404339
2-(4-(2-methylpyridin-4-yl)phenyl)-N-(5-phenylpyridin-2-yl)acetamide
CID 46927726
N-(3-methyl-2-pyridinyl)-2,2-diphenylacetamide
CID 4450213
N-[(6-carbamimidoylpyridin-3-yl)methyl]-2-{2-oxo-6-phenyl-3-[(2-phenylethyl)amino]-1,2-dihydropyrazin-1-yl}acetamide
CID 11762589
(2e,5r)-2-Imino-3-Methyl-5-Phenyl-5-[3-(Pyridin-3-Yl)phenyl]imidazolidin-4-One
CID 70685236
N-[2-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)ethyl]-N-pyridin-2-ylcyclohexanecarboxamide
CID 71455083

Frequently Asked Questions

What is the IUPAC name of 2-amino-5,5-diphenyl-3-(4-pyridin-2-ylbutyl)imidazol-4-one?
The IUPAC name of 2-amino-5,5-diphenyl-3-(4-pyridin-2-ylbutyl)imidazol-4-one (CID 44523659) is 2-amino-5,5-diphenyl-3-(4-pyridin-2-ylbutyl)imidazol-4-one.
What is the SMILES notation for 2-amino-5,5-diphenyl-3-(4-pyridin-2-ylbutyl)imidazol-4-one?
The canonical SMILES for 2-amino-5,5-diphenyl-3-(4-pyridin-2-ylbutyl)imidazol-4-one is NC1=NC(c2ccccc2)(c2ccccc2)C(=O)N1CCCCc1ccccn1.
What is the InChIKey of 2-amino-5,5-diphenyl-3-(4-pyridin-2-ylbutyl)imidazol-4-one?
The InChIKey is NMFFGVFJFHJARV-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H24N4O/c25-23-27-24(19-11-3-1-4-12-19,20-13-5-2-6-14-20)22(29)28(23)18-10-8-16-21-15-7-9-17-26-21/h1-7,9,11-15,17H,8,10,16,18H2,(H2,25,27).
What are the key properties of 2-amino-5,5-diphenyl-3-(4-pyridin-2-ylbutyl)imidazol-4-one?
2-amino-5,5-diphenyl-3-(4-pyridin-2-ylbutyl)imidazol-4-one has a molecular weight of 384.48 g/mol, XLogP of 3.51, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-5,5-diphenyl-3-(4-pyridin-2-ylbutyl)imidazol-4-one is sourced from PubChem (CID 44523659), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).