N,N-diethyl-2-[2-(3-methoxyphenyl)benzimidazol-1-yl]acetamide

C20H23N3O2 — CID 17001793

IUPACN,N-diethyl-2-[2-(3-methoxyphenyl)benzimidazol-1-yl]acetamide
SMILESCCN(CC)C(=O)Cn1c(-c2cccc(OC)c2)nc2ccccc21
InChIInChI=1S/C20H23N3O2/c1-4-22(5-2)19(24)14-23-18-12-7-6-11-17(18)21-20(23)15-9-8-10-16(13-15)25-3/h6-13H,4-5,14H2,1-3H3
InChIKeyTWCZMIJKMVHKHG-UHFFFAOYSA-N
MW337.42 g/mol
LogP3.58
Rot. Bonds6

About N,N-diethyl-2-[2-(3-methoxyphenyl)benzimidazol-1-yl]acetamide

N,N-diethyl-2-[2-(3-methoxyphenyl)benzimidazol-1-yl]acetamide (PubChem CID 17001793) has the molecular formula C20H23N3O2 and a molecular weight of 337.42 g/mol. Its IUPAC name is N,N-diethyl-2-[2-(3-methoxyphenyl)benzimidazol-1-yl]acetamide.

Molecular Properties

Compound NameN,N-diethyl-2-[2-(3-methoxyphenyl)benzimidazol-1-yl]acetamide
PubChem CID17001793
Molecular FormulaC20H23N3O2
Molecular Weight337.42 g/mol
Exact Mass337.18
IUPAC NameN,N-diethyl-2-[2-(3-methoxyphenyl)benzimidazol-1-yl]acetamide
SMILESCCN(CC)C(=O)Cn1c(-c2cccc(OC)c2)nc2ccccc21
InChIInChI=1S/C20H23N3O2/c1-4-22(5-2)19(24)14-23-18-12-7-6-11-17(18)21-20(23)15-9-8-10-16(13-15)25-3/h6-13H,4-5,14H2,1-3H3
InChIKeyTWCZMIJKMVHKHG-UHFFFAOYSA-N
XLogP3.58
TPSA47.36 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.42
LogP ≤ 53.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

2-[2-(3-methoxyphenyl)benzimidazol-1-yl]-N,N-bis(2-methylpropyl)acetamide
CID 17001797
N-butyl-2-[2-(3-methoxyphenyl)benzimidazol-1-yl]-N-methylacetamide
CID 17001798
2-[2-(3-methoxyphenyl)benzimidazol-1-yl]-N-propylacetamide
CID 17032912
2-(3-methoxyphenyl)-1-pentylbenzimidazole
CID 17001673
1-butyl-2-(3-methoxyphenyl)benzimidazole
CID 17001670
N-ethyl-2-[2-(4-methoxyphenyl)benzimidazol-1-yl]-N-phenylacetamide
CID 17001382
2-[2-(3-bromophenyl)benzimidazol-1-yl]-N,N-dipropylacetamide
CID 17001917
N,N-diethyl-2-[2-(3-methylphenyl)-4-oxoquinazolin-3-yl]acetamide
CID 4079953
ethyl 2-[2-(3-methylphenyl)benzimidazol-1-yl]acetate
CID 17000863
N,N-diethyl-2-[2-[1-(6-methoxynaphthalen-2-yl)ethyl]benzimidazol-1-yl]acetamide
CID 16996375
1-[2-(2,6-dimethylphenoxy)ethyl]-2-(3-methoxyphenyl)benzimidazole
CID 17001717
3-[2-(3-methoxyphenyl)benzimidazol-1-yl]propanethioamide
CID 94756511

Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-2-[2-(3-methoxyphenyl)benzimidazol-1-yl]acetamide?
The IUPAC name of N,N-diethyl-2-[2-(3-methoxyphenyl)benzimidazol-1-yl]acetamide (CID 17001793) is N,N-diethyl-2-[2-(3-methoxyphenyl)benzimidazol-1-yl]acetamide.
What is the SMILES notation for N,N-diethyl-2-[2-(3-methoxyphenyl)benzimidazol-1-yl]acetamide?
The canonical SMILES for N,N-diethyl-2-[2-(3-methoxyphenyl)benzimidazol-1-yl]acetamide is CCN(CC)C(=O)Cn1c(-c2cccc(OC)c2)nc2ccccc21.
What is the InChIKey of N,N-diethyl-2-[2-(3-methoxyphenyl)benzimidazol-1-yl]acetamide?
The InChIKey is TWCZMIJKMVHKHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23N3O2/c1-4-22(5-2)19(24)14-23-18-12-7-6-11-17(18)21-20(23)15-9-8-10-16(13-15)25-3/h6-13H,4-5,14H2,1-3H3.
What are the key properties of N,N-diethyl-2-[2-(3-methoxyphenyl)benzimidazol-1-yl]acetamide?
N,N-diethyl-2-[2-(3-methoxyphenyl)benzimidazol-1-yl]acetamide has a molecular weight of 337.42 g/mol, XLogP of 3.58, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-2-[2-(3-methoxyphenyl)benzimidazol-1-yl]acetamide is sourced from PubChem (CID 17001793), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).