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

C18H19N3O3 — CID 6459725

IUPACN-(1,3-dimethyl-2-oxobenzimidazol-5-yl)-2-(2-methylphenoxy)acetamide
SMILESCc1ccccc1OCC(=O)Nc1ccc2c(c1)n(C)c(=O)n2C
InChIInChI=1S/C18H19N3O3/c1-12-6-4-5-7-16(12)24-11-17(22)19-13-8-9-14-15(10-13)21(3)18(23)20(14)2/h4-10H,11H2,1-3H3,(H,19,22)
InChIKeyBCRPGOLYKLCRIC-UHFFFAOYSA-N
MW325.37 g/mol
LogP2.20
Rot. Bonds4

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

N-(1,3-dimethyl-2-oxobenzimidazol-5-yl)-2-(2-methylphenoxy)acetamide (PubChem CID 6459725) has the molecular formula C18H19N3O3 and a molecular weight of 325.37 g/mol. Its IUPAC name is N-(1,3-dimethyl-2-oxobenzimidazol-5-yl)-2-(2-methylphenoxy)acetamide.

Molecular Properties

Compound NameN-(1,3-dimethyl-2-oxobenzimidazol-5-yl)-2-(2-methylphenoxy)acetamide
PubChem CID6459725
Molecular FormulaC18H19N3O3
Molecular Weight325.37 g/mol
Exact Mass325.14
IUPAC NameN-(1,3-dimethyl-2-oxobenzimidazol-5-yl)-2-(2-methylphenoxy)acetamide
SMILESCc1ccccc1OCC(=O)Nc1ccc2c(c1)n(C)c(=O)n2C
InChIInChI=1S/C18H19N3O3/c1-12-6-4-5-7-16(12)24-11-17(22)19-13-8-9-14-15(10-13)21(3)18(23)20(14)2/h4-10H,11H2,1-3H3,(H,19,22)
InChIKeyBCRPGOLYKLCRIC-UHFFFAOYSA-N
XLogP2.20
TPSA65.26 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.37
LogP ≤ 52.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-tert-butyl-2-[2-methoxy-4-[[(2-oxo-1,3-dihydrobenzimidazol-5-yl)amino]methyl]phenoxy]acetamide
CID 655834
N-[3-(acetylamino)phenyl]-2-(2-methylphenoxy)acetamide
CID 683793
1,3-Dihydro-1-(2-(2-methylphenoxy)ethyl)-2H-benzimidazole-2-thione
CID 773461
5-{[2-(allyloxy)benzyl]amino}-1,3-dihydro-2H-benzimidazol-2-one
CID 2111513
5-{[4-(allyloxy)benzyl]amino}-1,3-dihydro-2H-benzimidazol-2-one
CID 2215000
(E)-3-(3-methoxyphenyl)-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)prop-2-enamide
CID 2407329
N-(1,3-dimethyl-2-oxo-2,3-dihydro-1H-benzimidazol-5-yl)-2-(4-methoxyphenoxy)acetamide
CID 2986111
N-(1,3-dimethyl-2-oxo-2,3-dihydro-1H-benzimidazol-5-yl)-2-phenoxyacetamide
CID 2988430
N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)-2-phenoxyacetamide
CID 4367953
N-(1,3-dimethyl-2-oxo-2,3-dihydro-1H-benzimidazol-5-yl)-2-(2-methoxyphenoxy)acetamide
CID 6458101
N-[2-(4-acetyl-1-piperazinyl)phenyl]-2-(2-methylphenoxy)acetamide
CID 6458731
N-(1,3-dimethyl-2-oxobenzimidazol-5-yl)-4-prop-2-enoxybenzamide
CID 6472813

Frequently Asked Questions

What is the IUPAC name of N-(1,3-dimethyl-2-oxobenzimidazol-5-yl)-2-(2-methylphenoxy)acetamide?
The IUPAC name of N-(1,3-dimethyl-2-oxobenzimidazol-5-yl)-2-(2-methylphenoxy)acetamide (CID 6459725) is N-(1,3-dimethyl-2-oxobenzimidazol-5-yl)-2-(2-methylphenoxy)acetamide.
What is the SMILES notation for N-(1,3-dimethyl-2-oxobenzimidazol-5-yl)-2-(2-methylphenoxy)acetamide?
The canonical SMILES for N-(1,3-dimethyl-2-oxobenzimidazol-5-yl)-2-(2-methylphenoxy)acetamide is Cc1ccccc1OCC(=O)Nc1ccc2c(c1)n(C)c(=O)n2C.
What is the InChIKey of N-(1,3-dimethyl-2-oxobenzimidazol-5-yl)-2-(2-methylphenoxy)acetamide?
The InChIKey is BCRPGOLYKLCRIC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19N3O3/c1-12-6-4-5-7-16(12)24-11-17(22)19-13-8-9-14-15(10-13)21(3)18(23)20(14)2/h4-10H,11H2,1-3H3,(H,19,22).
What are the key properties of N-(1,3-dimethyl-2-oxobenzimidazol-5-yl)-2-(2-methylphenoxy)acetamide?
N-(1,3-dimethyl-2-oxobenzimidazol-5-yl)-2-(2-methylphenoxy)acetamide has a molecular weight of 325.37 g/mol, XLogP of 2.20, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1,3-dimethyl-2-oxobenzimidazol-5-yl)-2-(2-methylphenoxy)acetamide is sourced from PubChem (CID 6459725), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).