N-[2-(2-methylbenzimidazol-1-yl)ethyl]-2-[2-(phenoxymethyl)benzimidazol-1-yl]acetamide

C26H25N5O2 — CID 24583706

IUPACN-[2-(2-methylbenzimidazol-1-yl)ethyl]-2-[2-(phenoxymethyl)benzimidazol-1-yl]acetamide
SMILESCc1nc2ccccc2n1CCNC(=O)Cn1c(COc2ccccc2)nc2ccccc21
InChIInChI=1S/C26H25N5O2/c1-19-28-21-11-5-7-13-23(21)30(19)16-15-27-26(32)17-31-24-14-8-6-12-22(24)29-25(31)18-33-20-9-3-2-4-10-20/h2-14H,15-18H2,1H3,(H,27,32)
InChIKeyLXCWCJUUHIEUOO-UHFFFAOYSA-N
MW439.52 g/mol
LogP4.09
Rot. Bonds8

About N-[2-(2-methylbenzimidazol-1-yl)ethyl]-2-[2-(phenoxymethyl)benzimidazol-1-yl]acetamide

N-[2-(2-methylbenzimidazol-1-yl)ethyl]-2-[2-(phenoxymethyl)benzimidazol-1-yl]acetamide (PubChem CID 24583706) has the molecular formula C26H25N5O2 and a molecular weight of 439.52 g/mol. Its IUPAC name is N-[2-(2-methylbenzimidazol-1-yl)ethyl]-2-[2-(phenoxymethyl)benzimidazol-1-yl]acetamide.

Molecular Properties

Compound NameN-[2-(2-methylbenzimidazol-1-yl)ethyl]-2-[2-(phenoxymethyl)benzimidazol-1-yl]acetamide
PubChem CID24583706
Molecular FormulaC26H25N5O2
Molecular Weight439.52 g/mol
Exact Mass439.20
IUPAC NameN-[2-(2-methylbenzimidazol-1-yl)ethyl]-2-[2-(phenoxymethyl)benzimidazol-1-yl]acetamide
SMILESCc1nc2ccccc2n1CCNC(=O)Cn1c(COc2ccccc2)nc2ccccc21
InChIInChI=1S/C26H25N5O2/c1-19-28-21-11-5-7-13-23(21)30(19)16-15-27-26(32)17-31-24-14-8-6-12-22(24)29-25(31)18-33-20-9-3-2-4-10-20/h2-14H,15-18H2,1H3,(H,27,32)
InChIKeyLXCWCJUUHIEUOO-UHFFFAOYSA-N
XLogP4.09
TPSA73.97 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500439.52
LogP ≤ 54.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-[3-(2-methylbenzimidazol-1-yl)propyl]-2-[2-(phenoxymethyl)benzimidazol-1-yl]acetamide
CID 112767743
N-(2-methoxyethyl)-2-[2-(phenoxymethyl)benzimidazol-1-yl]acetamide
CID 35805150
2-(2-methylbenzimidazol-1-yl)-N-(2-phenoxyethyl)acetamide
CID 51190450
N-[2-(2-methylbenzimidazol-1-yl)ethyl]-4-phenoxybutanamide
CID 40716506
N-butyl-2-[2-[(3-methylphenoxy)methyl]benzimidazol-1-yl]acetamide
CID 17031952
N-(2,5-dimethylphenyl)-2-[2-(phenoxymethyl)benzimidazol-1-yl]acetamide
CID 17031795
2-[2-[(4-chlorophenoxy)methyl]benzimidazol-1-yl]-N-[2-(diethylamino)ethyl]acetamide
CID 112759773
N-(2-imidazo[1,2-a]pyridin-2-ylethyl)-2-[2-(phenoxymethyl)benzimidazol-1-yl]acetamide
CID 25430739
N-[3-(2-oxoazepan-1-yl)propyl]-2-[2-(phenoxymethyl)benzimidazol-1-yl]acetamide
CID 112767643
2-(2-ethylbenzimidazol-1-yl)-N-[[2-(phenoxymethyl)phenyl]methyl]acetamide
CID 17417716
2-(4-methoxyphenyl)-N-[2-(2-methylbenzimidazol-1-yl)ethyl]acetamide
CID 40716430
2-[2-[(4-methylphenoxy)methyl]benzimidazol-1-yl]-N-propan-2-ylacetamide
CID 17032004

Frequently Asked Questions

What is the IUPAC name of N-[2-(2-methylbenzimidazol-1-yl)ethyl]-2-[2-(phenoxymethyl)benzimidazol-1-yl]acetamide?
The IUPAC name of N-[2-(2-methylbenzimidazol-1-yl)ethyl]-2-[2-(phenoxymethyl)benzimidazol-1-yl]acetamide (CID 24583706) is N-[2-(2-methylbenzimidazol-1-yl)ethyl]-2-[2-(phenoxymethyl)benzimidazol-1-yl]acetamide.
What is the SMILES notation for N-[2-(2-methylbenzimidazol-1-yl)ethyl]-2-[2-(phenoxymethyl)benzimidazol-1-yl]acetamide?
The canonical SMILES for N-[2-(2-methylbenzimidazol-1-yl)ethyl]-2-[2-(phenoxymethyl)benzimidazol-1-yl]acetamide is Cc1nc2ccccc2n1CCNC(=O)Cn1c(COc2ccccc2)nc2ccccc21.
What is the InChIKey of N-[2-(2-methylbenzimidazol-1-yl)ethyl]-2-[2-(phenoxymethyl)benzimidazol-1-yl]acetamide?
The InChIKey is LXCWCJUUHIEUOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H25N5O2/c1-19-28-21-11-5-7-13-23(21)30(19)16-15-27-26(32)17-31-24-14-8-6-12-22(24)29-25(31)18-33-20-9-3-2-4-10-20/h2-14H,15-18H2,1H3,(H,27,32).
What are the key properties of N-[2-(2-methylbenzimidazol-1-yl)ethyl]-2-[2-(phenoxymethyl)benzimidazol-1-yl]acetamide?
N-[2-(2-methylbenzimidazol-1-yl)ethyl]-2-[2-(phenoxymethyl)benzimidazol-1-yl]acetamide has a molecular weight of 439.52 g/mol, XLogP of 4.09, 8 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-methylbenzimidazol-1-yl)ethyl]-2-[2-(phenoxymethyl)benzimidazol-1-yl]acetamide is sourced from PubChem (CID 24583706), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).