4-methoxy-N-[1-methyl-2-(pyrrolidin-1-ylmethyl)benzimidazol-5-yl]benzamide

C21H24N4O2 — CID 6484093

IUPAC4-methoxy-N-[1-methyl-2-(pyrrolidin-1-ylmethyl)benzimidazol-5-yl]benzamide
SMILESCOc1ccc(C(=O)Nc2ccc3c(c2)nc(CN2CCCC2)n3C)cc1
InChIInChI=1S/C21H24N4O2/c1-24-19-10-7-16(22-21(26)15-5-8-17(27-2)9-6-15)13-18(19)23-20(24)14-25-11-3-4-12-25/h5-10,13H,3-4,11-12,14H2,1-2H3,(H,22,26)
InChIKeyFKQFTNZHHDASEC-UHFFFAOYSA-N
MW364.45 g/mol
LogP3.43
Rot. Bonds5

About 4-methoxy-N-[1-methyl-2-(pyrrolidin-1-ylmethyl)benzimidazol-5-yl]benzamide

4-methoxy-N-[1-methyl-2-(pyrrolidin-1-ylmethyl)benzimidazol-5-yl]benzamide (PubChem CID 6484093) has the molecular formula C21H24N4O2 and a molecular weight of 364.45 g/mol. Its IUPAC name is 4-methoxy-N-[1-methyl-2-(pyrrolidin-1-ylmethyl)benzimidazol-5-yl]benzamide.

Molecular Properties

Compound Name4-methoxy-N-[1-methyl-2-(pyrrolidin-1-ylmethyl)benzimidazol-5-yl]benzamide
PubChem CID6484093
Molecular FormulaC21H24N4O2
Molecular Weight364.45 g/mol
Exact Mass364.19
IUPAC Name4-methoxy-N-[1-methyl-2-(pyrrolidin-1-ylmethyl)benzimidazol-5-yl]benzamide
SMILESCOc1ccc(C(=O)Nc2ccc3c(c2)nc(CN2CCCC2)n3C)cc1
InChIInChI=1S/C21H24N4O2/c1-24-19-10-7-16(22-21(26)15-5-8-17(27-2)9-6-15)13-18(19)23-20(24)14-25-11-3-4-12-25/h5-10,13H,3-4,11-12,14H2,1-2H3,(H,22,26)
InChIKeyFKQFTNZHHDASEC-UHFFFAOYSA-N
XLogP3.43
TPSA59.39 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.45
LogP ≤ 53.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

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2-(4-methoxyphenyl)-1H-1,3-benzodiazole-4-carboxamide
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N-(1-methyl-2-(pyrrolidin-1-yl)-1H-benzo[d]imidazol-6-yl)-2-(4-(trifluoromethyl)phenoxy)acetamide
CID 11281523
N,N-diisopentyl-2-(4-methoxybenzoyl)-3-(3-(piperidin-1-yl)propyl)-3H-benzo[d]imidazole-5-carboxamide
CID 44432966
3,4,5-trimethoxy-N-(1-methylbenzimidazol-5-yl)benzamide
CID 929513
N-1H-Benzimidazol-2-yl-4-methoxybenzamide
CID 2081294
N-[(2E)-5-[benzene(methyl)amido]-1-(2-carbamoylethyl)-2,3-dihydro-1H-1,3-benzodiazol-2-ylidene]-4-methoxybenzamide
CID 25190504
N-[(2E)-5-[benzene(methyl)amido]-1-(2-carbamoylethyl)-2,3-dihydro-1H-1,3-benzodiazol-2-ylidene]-5-phenoxythiophene-2-carboxamide
CID 25190525
N-[(2E)-5-[benzene(methyl)amido]-1-(2-carbamoylethyl)-2,3-dihydro-1H-1,3-benzodiazol-2-ylidene]-5-(benzyloxy)thiophene-2-carboxamide
CID 25190526
2-Aminobenzimidazole with trans-stilbene, 8h
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2-Aminobenzimidazole with trans-stilbene, 8i
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Frequently Asked Questions

What is the IUPAC name of 4-methoxy-N-[1-methyl-2-(pyrrolidin-1-ylmethyl)benzimidazol-5-yl]benzamide?
The IUPAC name of 4-methoxy-N-[1-methyl-2-(pyrrolidin-1-ylmethyl)benzimidazol-5-yl]benzamide (CID 6484093) is 4-methoxy-N-[1-methyl-2-(pyrrolidin-1-ylmethyl)benzimidazol-5-yl]benzamide.
What is the SMILES notation for 4-methoxy-N-[1-methyl-2-(pyrrolidin-1-ylmethyl)benzimidazol-5-yl]benzamide?
The canonical SMILES for 4-methoxy-N-[1-methyl-2-(pyrrolidin-1-ylmethyl)benzimidazol-5-yl]benzamide is COc1ccc(C(=O)Nc2ccc3c(c2)nc(CN2CCCC2)n3C)cc1.
What is the InChIKey of 4-methoxy-N-[1-methyl-2-(pyrrolidin-1-ylmethyl)benzimidazol-5-yl]benzamide?
The InChIKey is FKQFTNZHHDASEC-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H24N4O2/c1-24-19-10-7-16(22-21(26)15-5-8-17(27-2)9-6-15)13-18(19)23-20(24)14-25-11-3-4-12-25/h5-10,13H,3-4,11-12,14H2,1-2H3,(H,22,26).
What are the key properties of 4-methoxy-N-[1-methyl-2-(pyrrolidin-1-ylmethyl)benzimidazol-5-yl]benzamide?
4-methoxy-N-[1-methyl-2-(pyrrolidin-1-ylmethyl)benzimidazol-5-yl]benzamide has a molecular weight of 364.45 g/mol, XLogP of 3.43, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-N-[1-methyl-2-(pyrrolidin-1-ylmethyl)benzimidazol-5-yl]benzamide is sourced from PubChem (CID 6484093), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).