N-(5-chloro-2-methylphenyl)-2-(1,3-dimethyl-2-oxobenzimidazol-5-yl)acetamide

C18H18ClN3O2 — CID 110772315

IUPACN-(5-chloro-2-methylphenyl)-2-(1,3-dimethyl-2-oxobenzimidazol-5-yl)acetamide
SMILESCc1ccc(Cl)cc1NC(=O)Cc1ccc2c(c1)n(C)c(=O)n2C
InChIInChI=1S/C18H18ClN3O2/c1-11-4-6-13(19)10-14(11)20-17(23)9-12-5-7-15-16(8-12)22(3)18(24)21(15)2/h4-8,10H,9H2,1-3H3,(H,20,23)
InChIKeyZRGLAXNXXFGWJN-UHFFFAOYSA-N
MW343.81 g/mol
LogP3.02
Rot. Bonds3

About N-(5-chloro-2-methylphenyl)-2-(1,3-dimethyl-2-oxobenzimidazol-5-yl)acetamide

N-(5-chloro-2-methylphenyl)-2-(1,3-dimethyl-2-oxobenzimidazol-5-yl)acetamide (PubChem CID 110772315) has the molecular formula C18H18ClN3O2 and a molecular weight of 343.81 g/mol. Its IUPAC name is N-(5-chloro-2-methylphenyl)-2-(1,3-dimethyl-2-oxobenzimidazol-5-yl)acetamide.

Molecular Properties

Compound NameN-(5-chloro-2-methylphenyl)-2-(1,3-dimethyl-2-oxobenzimidazol-5-yl)acetamide
PubChem CID110772315
Molecular FormulaC18H18ClN3O2
Molecular Weight343.81 g/mol
Exact Mass343.11
IUPAC NameN-(5-chloro-2-methylphenyl)-2-(1,3-dimethyl-2-oxobenzimidazol-5-yl)acetamide
SMILESCc1ccc(Cl)cc1NC(=O)Cc1ccc2c(c1)n(C)c(=O)n2C
InChIInChI=1S/C18H18ClN3O2/c1-11-4-6-13(19)10-14(11)20-17(23)9-12-5-7-15-16(8-12)22(3)18(24)21(15)2/h4-8,10H,9H2,1-3H3,(H,20,23)
InChIKeyZRGLAXNXXFGWJN-UHFFFAOYSA-N
XLogP3.02
TPSA56.03 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.81
LogP ≤ 53.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(5-chloro-2-methylphenyl)-2-(4-hydroxyphenyl)acetamide
CID 78838585
N-(5-chloro-2-methylphenyl)-2-(4-fluorophenyl)acetamide
CID 808427
N,N'-bis(5-chloro-2-methylphenyl)propanediamide
CID 1340673
N-(5-chloro-2-methylphenyl)-2-[(4-chlorophenyl)methylamino]acetamide
CID 43405190
N-(5-chloro-2-methylphenyl)-2-(3-oxo-4H-1,4-benzothiazin-6-yl)acetamide
CID 110771540
2-(1,3-dimethyl-2-oxobenzimidazol-5-yl)acetic acid
CID 45157012
N-(5-chloro-2-methylphenyl)-2-(2-methylphenyl)acetamide
CID 8624306
N-(5-chloro-2-methylphenyl)-2-(3-methoxyphenyl)acetamide
CID 3576472
N-(5-chloro-2-methylphenyl)-2-(2,2-dimethylpropylamino)acetamide
CID 61165845
1-(5-chloro-2-methylphenyl)-3-(1,3-dimethyl-2-oxo-6-phenoxybenzimidazol-5-yl)urea
CID 50797513
3-[[2-(4-chlorophenyl)acetyl]amino]-4-methylbenzoic acid
CID 893334
N'-(5-chloro-2-methylphenyl)-N-[(4-chlorophenyl)methyl]propanediamide
CID 108946767

Frequently Asked Questions

What is the IUPAC name of N-(5-chloro-2-methylphenyl)-2-(1,3-dimethyl-2-oxobenzimidazol-5-yl)acetamide?
The IUPAC name of N-(5-chloro-2-methylphenyl)-2-(1,3-dimethyl-2-oxobenzimidazol-5-yl)acetamide (CID 110772315) is N-(5-chloro-2-methylphenyl)-2-(1,3-dimethyl-2-oxobenzimidazol-5-yl)acetamide.
What is the SMILES notation for N-(5-chloro-2-methylphenyl)-2-(1,3-dimethyl-2-oxobenzimidazol-5-yl)acetamide?
The canonical SMILES for N-(5-chloro-2-methylphenyl)-2-(1,3-dimethyl-2-oxobenzimidazol-5-yl)acetamide is Cc1ccc(Cl)cc1NC(=O)Cc1ccc2c(c1)n(C)c(=O)n2C.
What is the InChIKey of N-(5-chloro-2-methylphenyl)-2-(1,3-dimethyl-2-oxobenzimidazol-5-yl)acetamide?
The InChIKey is ZRGLAXNXXFGWJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18ClN3O2/c1-11-4-6-13(19)10-14(11)20-17(23)9-12-5-7-15-16(8-12)22(3)18(24)21(15)2/h4-8,10H,9H2,1-3H3,(H,20,23).
What are the key properties of N-(5-chloro-2-methylphenyl)-2-(1,3-dimethyl-2-oxobenzimidazol-5-yl)acetamide?
N-(5-chloro-2-methylphenyl)-2-(1,3-dimethyl-2-oxobenzimidazol-5-yl)acetamide has a molecular weight of 343.81 g/mol, XLogP of 3.02, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-chloro-2-methylphenyl)-2-(1,3-dimethyl-2-oxobenzimidazol-5-yl)acetamide is sourced from PubChem (CID 110772315), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).