2-(2-methoxyphenoxy)-N-[2-(2-oxo-3H-benzimidazol-1-yl)ethyl]acetamide

C18H19N3O4 — CID 110400765

IUPAC2-(2-methoxyphenoxy)-N-[2-(2-oxo-3H-benzimidazol-1-yl)ethyl]acetamide
SMILESCOc1ccccc1OCC(=O)NCCn1c(=O)[nH]c2ccccc21
InChIInChI=1S/C18H19N3O4/c1-24-15-8-4-5-9-16(15)25-12-17(22)19-10-11-21-14-7-3-2-6-13(14)20-18(21)23/h2-9H,10-12H2,1H3,(H,19,22)(H,20,23)
InChIKeyYAKSEHYRELXNPD-UHFFFAOYSA-N
MW341.37 g/mol
LogP1.53
Rot. Bonds7

About 2-(2-methoxyphenoxy)-N-[2-(2-oxo-3H-benzimidazol-1-yl)ethyl]acetamide

2-(2-methoxyphenoxy)-N-[2-(2-oxo-3H-benzimidazol-1-yl)ethyl]acetamide (PubChem CID 110400765) has the molecular formula C18H19N3O4 and a molecular weight of 341.37 g/mol. Its IUPAC name is 2-(2-methoxyphenoxy)-N-[2-(2-oxo-3H-benzimidazol-1-yl)ethyl]acetamide.

Molecular Properties

Compound Name2-(2-methoxyphenoxy)-N-[2-(2-oxo-3H-benzimidazol-1-yl)ethyl]acetamide
PubChem CID110400765
Molecular FormulaC18H19N3O4
Molecular Weight341.37 g/mol
Exact Mass341.14
IUPAC Name2-(2-methoxyphenoxy)-N-[2-(2-oxo-3H-benzimidazol-1-yl)ethyl]acetamide
SMILESCOc1ccccc1OCC(=O)NCCn1c(=O)[nH]c2ccccc21
InChIInChI=1S/C18H19N3O4/c1-24-15-8-4-5-9-16(15)25-12-17(22)19-10-11-21-14-7-3-2-6-13(14)20-18(21)23/h2-9H,10-12H2,1H3,(H,19,22)(H,20,23)
InChIKeyYAKSEHYRELXNPD-UHFFFAOYSA-N
XLogP1.53
TPSA85.35 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.37
LogP ≤ 51.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

1-[2-(2-methoxyphenyl)ethyl]-3-[2-(2-oxo-3H-benzimidazol-1-yl)ethyl]urea
CID 110610908
3-(2-methoxyphenyl)-N-[3-(2-oxo-3H-benzimidazol-1-yl)propyl]propanamide
CID 110419764
N-[2-(2-oxo-3H-benzimidazol-1-yl)ethyl]-2-phenylacetamide
CID 110400739
3-bromo-4-methoxy-N-[2-(2-oxo-3H-benzimidazol-1-yl)ethyl]benzamide
CID 110610885
3,4,5-trimethoxy-N-[3-(2-oxo-3H-benzimidazol-1-yl)propyl]benzamide
CID 110419706
phenyl N-[2-(2-oxo-3H-benzimidazol-1-yl)ethyl]carbamate
CID 110400773
2-(2-methoxyphenoxy)-N-[2-(1H-pyrrol-3-yl)ethyl]acetamide
CID 110789371
N-[2-(2-oxo-3H-benzimidazol-1-yl)ethyl]-3-thiophen-2-ylpropanamide
CID 110400789
N-hexyl-2-(2-methoxyphenoxy)acetamide
CID 19169780
2-(2-methoxyphenoxy)-N-(2-morpholin-4-ylethyl)acetamide
CID 806992
N-(3-indol-1-ylpropyl)-2-(2-methoxyphenoxy)acetamide
CID 18120698
2-(2-methoxyphenoxy)-N-[5-(4-methylpiperazin-1-yl)pentyl]acetamide
CID 110443295

Frequently Asked Questions

What is the IUPAC name of 2-(2-methoxyphenoxy)-N-[2-(2-oxo-3H-benzimidazol-1-yl)ethyl]acetamide?
The IUPAC name of 2-(2-methoxyphenoxy)-N-[2-(2-oxo-3H-benzimidazol-1-yl)ethyl]acetamide (CID 110400765) is 2-(2-methoxyphenoxy)-N-[2-(2-oxo-3H-benzimidazol-1-yl)ethyl]acetamide.
What is the SMILES notation for 2-(2-methoxyphenoxy)-N-[2-(2-oxo-3H-benzimidazol-1-yl)ethyl]acetamide?
The canonical SMILES for 2-(2-methoxyphenoxy)-N-[2-(2-oxo-3H-benzimidazol-1-yl)ethyl]acetamide is COc1ccccc1OCC(=O)NCCn1c(=O)[nH]c2ccccc21.
What is the InChIKey of 2-(2-methoxyphenoxy)-N-[2-(2-oxo-3H-benzimidazol-1-yl)ethyl]acetamide?
The InChIKey is YAKSEHYRELXNPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19N3O4/c1-24-15-8-4-5-9-16(15)25-12-17(22)19-10-11-21-14-7-3-2-6-13(14)20-18(21)23/h2-9H,10-12H2,1H3,(H,19,22)(H,20,23).
What are the key properties of 2-(2-methoxyphenoxy)-N-[2-(2-oxo-3H-benzimidazol-1-yl)ethyl]acetamide?
2-(2-methoxyphenoxy)-N-[2-(2-oxo-3H-benzimidazol-1-yl)ethyl]acetamide has a molecular weight of 341.37 g/mol, XLogP of 1.53, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methoxyphenoxy)-N-[2-(2-oxo-3H-benzimidazol-1-yl)ethyl]acetamide is sourced from PubChem (CID 110400765), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).