3-acetamido-N-[2-(1-methylbenzimidazol-5-yl)ethyl]benzamide

C19H20N4O2 — CID 110796161

IUPAC3-acetamido-N-[2-(1-methylbenzimidazol-5-yl)ethyl]benzamide
SMILESCC(=O)Nc1cccc(C(=O)NCCc2ccc3c(c2)ncn3C)c1
InChIInChI=1S/C19H20N4O2/c1-13(24)22-16-5-3-4-15(11-16)19(25)20-9-8-14-6-7-18-17(10-14)21-12-23(18)2/h3-7,10-12H,8-9H2,1-2H3,(H,20,25)(H,22,24)
InChIKeyBIVFPTAXQAZPKQ-UHFFFAOYSA-N
MW336.40 g/mol
LogP2.50
Rot. Bonds5

About 3-acetamido-N-[2-(1-methylbenzimidazol-5-yl)ethyl]benzamide

3-acetamido-N-[2-(1-methylbenzimidazol-5-yl)ethyl]benzamide (PubChem CID 110796161) has the molecular formula C19H20N4O2 and a molecular weight of 336.40 g/mol. Its IUPAC name is 3-acetamido-N-[2-(1-methylbenzimidazol-5-yl)ethyl]benzamide.

Molecular Properties

Compound Name3-acetamido-N-[2-(1-methylbenzimidazol-5-yl)ethyl]benzamide
PubChem CID110796161
Molecular FormulaC19H20N4O2
Molecular Weight336.40 g/mol
Exact Mass336.16
IUPAC Name3-acetamido-N-[2-(1-methylbenzimidazol-5-yl)ethyl]benzamide
SMILESCC(=O)Nc1cccc(C(=O)NCCc2ccc3c(c2)ncn3C)c1
InChIInChI=1S/C19H20N4O2/c1-13(24)22-16-5-3-4-15(11-16)19(25)20-9-8-14-6-7-18-17(10-14)21-12-23(18)2/h3-7,10-12H,8-9H2,1-2H3,(H,20,25)(H,22,24)
InChIKeyBIVFPTAXQAZPKQ-UHFFFAOYSA-N
XLogP2.50
TPSA76.02 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.40
LogP ≤ 52.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-methyl-N-[2-(1-methylbenzimidazol-5-yl)ethyl]benzamide
CID 110791606
N-[2-(4-chlorophenyl)ethyl]-1-methylbenzimidazole-5-carboxamide
CID 110692599
N-[2-(4-methoxyphenyl)ethyl]-1-methylbenzimidazole-5-carboxamide
CID 110692591
methyl 3-[[2-(1-methylbenzimidazol-5-yl)acetyl]amino]benzoate
CID 110772985
N-[2-(1-methylbenzimidazol-5-yl)ethyl]-2-(4-methylphenyl)acetamide
CID 110791656
3-chloro-N-[2-(1-methylbenzimidazol-5-yl)ethyl]propanamide
CID 115162649
3-methoxy-N-[(1-methylbenzimidazol-5-yl)methyl]benzamide
CID 110785783
3-amino-2-hydroxy-N-[2-(1-methylbenzimidazol-5-yl)ethyl]propanamide
CID 115180781
N-[2-(1-methylbenzimidazol-5-yl)ethyl]azetidine-3-carboxamide
CID 115159038
benzyl N-[2-(1-methylbenzimidazol-5-yl)ethyl]carbamate
CID 110791642
3-acetamido-N-[2-(1-methylimidazol-2-yl)sulfanylethyl]benzamide
CID 39969916
3-acetamido-N-[2-(2-methyl-1H-imidazol-5-yl)ethyl]benzamide
CID 110666440

Frequently Asked Questions

What is the IUPAC name of 3-acetamido-N-[2-(1-methylbenzimidazol-5-yl)ethyl]benzamide?
The IUPAC name of 3-acetamido-N-[2-(1-methylbenzimidazol-5-yl)ethyl]benzamide (CID 110796161) is 3-acetamido-N-[2-(1-methylbenzimidazol-5-yl)ethyl]benzamide.
What is the SMILES notation for 3-acetamido-N-[2-(1-methylbenzimidazol-5-yl)ethyl]benzamide?
The canonical SMILES for 3-acetamido-N-[2-(1-methylbenzimidazol-5-yl)ethyl]benzamide is CC(=O)Nc1cccc(C(=O)NCCc2ccc3c(c2)ncn3C)c1.
What is the InChIKey of 3-acetamido-N-[2-(1-methylbenzimidazol-5-yl)ethyl]benzamide?
The InChIKey is BIVFPTAXQAZPKQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N4O2/c1-13(24)22-16-5-3-4-15(11-16)19(25)20-9-8-14-6-7-18-17(10-14)21-12-23(18)2/h3-7,10-12H,8-9H2,1-2H3,(H,20,25)(H,22,24).
What are the key properties of 3-acetamido-N-[2-(1-methylbenzimidazol-5-yl)ethyl]benzamide?
3-acetamido-N-[2-(1-methylbenzimidazol-5-yl)ethyl]benzamide has a molecular weight of 336.40 g/mol, XLogP of 2.50, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-acetamido-N-[2-(1-methylbenzimidazol-5-yl)ethyl]benzamide is sourced from PubChem (CID 110796161), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).