N-[(1-methylbenzimidazol-2-yl)methyl]-2-[(4R)-4-methyl-3-(4-methylphenyl)-2,5-dioxoimidazolidin-1-yl]acetamide

C22H23N5O3 — CID 25372152

IUPACN-[(1-methylbenzimidazol-2-yl)methyl]-2-[(4R)-4-methyl-3-(4-methylphenyl)-2,5-dioxoimidazolidin-1-yl]acetamide
SMILESCc1ccc(N2C(=O)N(CC(=O)NCc3nc4ccccc4n3C)C(=O)[C@H]2C)cc1
InChIInChI=1S/C22H23N5O3/c1-14-8-10-16(11-9-14)27-15(2)21(29)26(22(27)30)13-20(28)23-12-19-24-17-6-4-5-7-18(17)25(19)3/h4-11,15H,12-13H2,1-3H3,(H,23,28)/t15-/m1/s1
InChIKeyDTSVKXKINXUZFU-OAHLLOKOSA-N
MW405.46 g/mol
LogP2.36
Rot. Bonds5

About N-[(1-methylbenzimidazol-2-yl)methyl]-2-[(4R)-4-methyl-3-(4-methylphenyl)-2,5-dioxoimidazolidin-1-yl]acetamide

N-[(1-methylbenzimidazol-2-yl)methyl]-2-[(4R)-4-methyl-3-(4-methylphenyl)-2,5-dioxoimidazolidin-1-yl]acetamide (PubChem CID 25372152) has the molecular formula C22H23N5O3 and a molecular weight of 405.46 g/mol. Its IUPAC name is N-[(1-methylbenzimidazol-2-yl)methyl]-2-[(4R)-4-methyl-3-(4-methylphenyl)-2,5-dioxoimidazolidin-1-yl]acetamide.

Molecular Properties

Compound NameN-[(1-methylbenzimidazol-2-yl)methyl]-2-[(4R)-4-methyl-3-(4-methylphenyl)-2,5-dioxoimidazolidin-1-yl]acetamide
PubChem CID25372152
Molecular FormulaC22H23N5O3
Molecular Weight405.46 g/mol
Exact Mass405.18
IUPAC NameN-[(1-methylbenzimidazol-2-yl)methyl]-2-[(4R)-4-methyl-3-(4-methylphenyl)-2,5-dioxoimidazolidin-1-yl]acetamide
SMILESCc1ccc(N2C(=O)N(CC(=O)NCc3nc4ccccc4n3C)C(=O)[C@H]2C)cc1
InChIInChI=1S/C22H23N5O3/c1-14-8-10-16(11-9-14)27-15(2)21(29)26(22(27)30)13-20(28)23-12-19-24-17-6-4-5-7-18(17)25(19)3/h4-11,15H,12-13H2,1-3H3,(H,23,28)/t15-/m1/s1
InChIKeyDTSVKXKINXUZFU-OAHLLOKOSA-N
XLogP2.36
TPSA87.54 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500405.46
LogP ≤ 52.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

N-methyl-2-[(4S)-4-methyl-3-(4-methylphenyl)-2,5-dioxoimidazolidin-1-yl]acetamide
CID 51639717
3-[(3aR,7aR)-1,3-dioxo-3a,4,7,7a-tetrahydroisoindol-2-yl]-N-[(1-methylbenzimidazol-2-yl)methyl]propanamide
CID 51510547
N-cyclohexyl-2-[(4R)-4-methyl-3-(4-methylphenyl)-2,5-dioxoimidazolidin-1-yl]acetamide
CID 2439184
(5R)-5-methyl-1-(4-methylphenyl)-3-[2-oxo-2-(4-phenylphenyl)ethyl]imidazolidine-2,4-dione
CID 2470328
N-[(1-methylbenzimidazol-2-yl)methyl]-2-(8-methyl-4-oxoquinazolin-3-yl)acetamide
CID 134041392
2-[(4,6-dimethylpyrimidin-2-yl)amino]-N-[(1-methylbenzimidazol-2-yl)methyl]acetamide
CID 91823103
N-[(1-methylbenzimidazol-2-yl)methyl]-2-(3-oxo-6,7,8,9-tetrahydro-5H-cyclohepta[c]pyridazin-2-yl)acetamide
CID 75465953
2-[1-(4-chlorophenyl)-3,5-dimethylpyrazol-4-yl]-N-[(1-methylbenzimidazol-2-yl)methyl]acetamide
CID 55756919
N-[(4R)-3,4-dihydro-2H-chromen-4-yl]-2-[(4R)-4-methyl-3-(4-methylphenyl)-2,5-dioxoimidazolidin-1-yl]acetamide
CID 9047889
3-[(4S)-1-benzyl-2,5-dioxoimidazolidin-4-yl]-N-[(1-methylbenzimidazol-2-yl)methyl]propanamide
CID 75489076
(4-oxopyrimido[2,1-b][1,3]benzothiazol-2-yl)methyl 2-[(4S)-4-methyl-3-(4-methylphenyl)-2,5-dioxoimidazolidin-1-yl]acetate
CID 51644957
3-[2-(2,6-dimethylmorpholin-4-yl)-2-oxoethyl]-5-methyl-1-(4-methylphenyl)imidazolidine-2,4-dione
CID 18074159

Frequently Asked Questions

What is the IUPAC name of N-[(1-methylbenzimidazol-2-yl)methyl]-2-[(4R)-4-methyl-3-(4-methylphenyl)-2,5-dioxoimidazolidin-1-yl]acetamide?
The IUPAC name of N-[(1-methylbenzimidazol-2-yl)methyl]-2-[(4R)-4-methyl-3-(4-methylphenyl)-2,5-dioxoimidazolidin-1-yl]acetamide (CID 25372152) is N-[(1-methylbenzimidazol-2-yl)methyl]-2-[(4R)-4-methyl-3-(4-methylphenyl)-2,5-dioxoimidazolidin-1-yl]acetamide.
What is the SMILES notation for N-[(1-methylbenzimidazol-2-yl)methyl]-2-[(4R)-4-methyl-3-(4-methylphenyl)-2,5-dioxoimidazolidin-1-yl]acetamide?
The canonical SMILES for N-[(1-methylbenzimidazol-2-yl)methyl]-2-[(4R)-4-methyl-3-(4-methylphenyl)-2,5-dioxoimidazolidin-1-yl]acetamide is Cc1ccc(N2C(=O)N(CC(=O)NCc3nc4ccccc4n3C)C(=O)[C@H]2C)cc1.
What is the InChIKey of N-[(1-methylbenzimidazol-2-yl)methyl]-2-[(4R)-4-methyl-3-(4-methylphenyl)-2,5-dioxoimidazolidin-1-yl]acetamide?
The InChIKey is DTSVKXKINXUZFU-OAHLLOKOSA-N. The full InChI is InChI=1S/C22H23N5O3/c1-14-8-10-16(11-9-14)27-15(2)21(29)26(22(27)30)13-20(28)23-12-19-24-17-6-4-5-7-18(17)25(19)3/h4-11,15H,12-13H2,1-3H3,(H,23,28)/t15-/m1/s1.
What are the key properties of N-[(1-methylbenzimidazol-2-yl)methyl]-2-[(4R)-4-methyl-3-(4-methylphenyl)-2,5-dioxoimidazolidin-1-yl]acetamide?
N-[(1-methylbenzimidazol-2-yl)methyl]-2-[(4R)-4-methyl-3-(4-methylphenyl)-2,5-dioxoimidazolidin-1-yl]acetamide has a molecular weight of 405.46 g/mol, XLogP of 2.36, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-methylbenzimidazol-2-yl)methyl]-2-[(4R)-4-methyl-3-(4-methylphenyl)-2,5-dioxoimidazolidin-1-yl]acetamide is sourced from PubChem (CID 25372152), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).