3-ethoxy-N-[1-(2-piperidin-1-ylethyl)benzimidazol-2-yl]benzamide

C23H28N4O2 — CID 35592391

IUPAC3-ethoxy-N-[1-(2-piperidin-1-ylethyl)benzimidazol-2-yl]benzamide
SMILESCCOc1cccc(C(=O)Nc2nc3ccccc3n2CCN2CCCCC2)c1
InChIInChI=1S/C23H28N4O2/c1-2-29-19-10-8-9-18(17-19)22(28)25-23-24-20-11-4-5-12-21(20)27(23)16-15-26-13-6-3-7-14-26/h4-5,8-12,17H,2-3,6-7,13-16H2,1H3,(H,24,25,28)
InChIKeyPQZSKDFEVPTEEO-UHFFFAOYSA-N
MW392.50 g/mol
LogP4.17
Rot. Bonds7

About 3-ethoxy-N-[1-(2-piperidin-1-ylethyl)benzimidazol-2-yl]benzamide

3-ethoxy-N-[1-(2-piperidin-1-ylethyl)benzimidazol-2-yl]benzamide (PubChem CID 35592391) has the molecular formula C23H28N4O2 and a molecular weight of 392.50 g/mol. Its IUPAC name is 3-ethoxy-N-[1-(2-piperidin-1-ylethyl)benzimidazol-2-yl]benzamide.

Molecular Properties

Compound Name3-ethoxy-N-[1-(2-piperidin-1-ylethyl)benzimidazol-2-yl]benzamide
PubChem CID35592391
Molecular FormulaC23H28N4O2
Molecular Weight392.50 g/mol
Exact Mass392.22
IUPAC Name3-ethoxy-N-[1-(2-piperidin-1-ylethyl)benzimidazol-2-yl]benzamide
SMILESCCOc1cccc(C(=O)Nc2nc3ccccc3n2CCN2CCCCC2)c1
InChIInChI=1S/C23H28N4O2/c1-2-29-19-10-8-9-18(17-19)22(28)25-23-24-20-11-4-5-12-21(20)27(23)16-15-26-13-6-3-7-14-26/h4-5,8-12,17H,2-3,6-7,13-16H2,1H3,(H,24,25,28)
InChIKeyPQZSKDFEVPTEEO-UHFFFAOYSA-N
XLogP4.17
TPSA59.39 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500392.50
LogP ≤ 54.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[1-(2-piperidin-1-ylethyl)benzimidazol-2-yl]pyridine-4-carboxamide
CID 19576141
2,6-difluoro-N-[1-(2-piperidin-1-ylethyl)benzimidazol-2-yl]benzamide
CID 17374527
1-(4-methoxyphenyl)-3-[1-(2-piperidin-1-ylethyl)benzimidazol-2-yl]urea
CID 39735359
N-[1-(2-pyrrolidin-1-ylethyl)benzimidazol-2-yl]pyrazine-2-carboxamide
CID 118725842
2,5-dimethyl-N-[1-(2-piperidin-1-ylethyl)benzimidazol-2-yl]furan-3-carboxamide
CID 35524627
ethane;N-[1-[2-(4-methylpiperazin-1-yl)ethyl]benzimidazol-2-yl]-3-nitrobenzamide
CID 159428795
2-fluoro-N-[1-(2-pyrrolidin-1-ylethyl)benzimidazol-2-yl]benzamide
CID 118725742
3-methyl-N-(1-propylbenzimidazol-2-yl)benzamide
CID 8914480
3-chloro-N-(1-propylbenzimidazol-2-yl)benzamide
CID 4800861
3-amino-N-[1-(3-ethoxypropyl)benzimidazol-2-yl]benzamide;hydrochloride
CID 119770789
N-methyl-1-(2-pyrrolidin-1-ylethyl)benzimidazol-2-amine
CID 82359477
methyl 3-[2-[(3-aminobenzoyl)amino]benzimidazol-1-yl]propanoate
CID 68792716

Frequently Asked Questions

What is the IUPAC name of 3-ethoxy-N-[1-(2-piperidin-1-ylethyl)benzimidazol-2-yl]benzamide?
The IUPAC name of 3-ethoxy-N-[1-(2-piperidin-1-ylethyl)benzimidazol-2-yl]benzamide (CID 35592391) is 3-ethoxy-N-[1-(2-piperidin-1-ylethyl)benzimidazol-2-yl]benzamide.
What is the SMILES notation for 3-ethoxy-N-[1-(2-piperidin-1-ylethyl)benzimidazol-2-yl]benzamide?
The canonical SMILES for 3-ethoxy-N-[1-(2-piperidin-1-ylethyl)benzimidazol-2-yl]benzamide is CCOc1cccc(C(=O)Nc2nc3ccccc3n2CCN2CCCCC2)c1.
What is the InChIKey of 3-ethoxy-N-[1-(2-piperidin-1-ylethyl)benzimidazol-2-yl]benzamide?
The InChIKey is PQZSKDFEVPTEEO-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H28N4O2/c1-2-29-19-10-8-9-18(17-19)22(28)25-23-24-20-11-4-5-12-21(20)27(23)16-15-26-13-6-3-7-14-26/h4-5,8-12,17H,2-3,6-7,13-16H2,1H3,(H,24,25,28).
What are the key properties of 3-ethoxy-N-[1-(2-piperidin-1-ylethyl)benzimidazol-2-yl]benzamide?
3-ethoxy-N-[1-(2-piperidin-1-ylethyl)benzimidazol-2-yl]benzamide has a molecular weight of 392.50 g/mol, XLogP of 4.17, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethoxy-N-[1-(2-piperidin-1-ylethyl)benzimidazol-2-yl]benzamide is sourced from PubChem (CID 35592391), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).