N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]acetamide

C12H11N5O — CID 135909510

IUPACN-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]acetamide
SMILESCC(=O)Nc1cn[nH]c1-c1nc2ccccc2[nH]1
InChIInChI=1S/C12H11N5O/c1-7(18)14-10-6-13-17-11(10)12-15-8-4-2-3-5-9(8)16-12/h2-6H,1H3,(H,13,17)(H,14,18)(H,15,16)
InChIKeyLEFKZSWCBZBDLU-UHFFFAOYSA-N
MW241.25 g/mol
LogP1.91
Rot. Bonds2

About N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]acetamide

N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]acetamide (PubChem CID 135909510) has the molecular formula C12H11N5O and a molecular weight of 241.25 g/mol. Its IUPAC name is N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]acetamide.

Molecular Properties

Compound NameN-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]acetamide
PubChem CID135909510
Molecular FormulaC12H11N5O
Molecular Weight241.25 g/mol
Exact Mass241.10
IUPAC NameN-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]acetamide
SMILESCC(=O)Nc1cn[nH]c1-c1nc2ccccc2[nH]1
InChIInChI=1S/C12H11N5O/c1-7(18)14-10-6-13-17-11(10)12-15-8-4-2-3-5-9(8)16-12/h2-6H,1H3,(H,13,17)(H,14,18)(H,15,16)
InChIKeyLEFKZSWCBZBDLU-UHFFFAOYSA-N
XLogP1.91
TPSA86.46 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.25
LogP ≤ 51.91
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

2-(1H-Pyrazol-5-yl)-1H-1,3-benzodiazole
CID 763936
N-(3-(1H-Benzimidazol-2-yl)-1H-pyrazol-4-yl)benzamide
CID 135566361
Rabenzazole
CID 38441
Meribendan
CID 65934
1-(4-Amino-6-Methyl-1,3,5-Triazin-2-Yl)-N-(1h-Pyrazol-3-Yl)-1h-Benzimidazol-2-Amine
CID 46892845
N-[2-(1H-benzimidazol-2-yl)ethyl]-2-(4-nitro-1H-pyrazol-1-yl)acetamide
CID 1509773
N-[4-(1H-benzimidazol-2-yl)phenyl]-1-[(1-ethyl-3-methylpyrazol-4-yl)methyl]piperidine-3-carboxamide
CID 24818949
2-(1-methyl-1H-pyrazol-4-yl)-1H-benzimidazole
CID 16227558
N-(1H-benzimidazol-2-yl)-3-(1-imidazolyl)propanamide
CID 4876712
N-[2-(1H-benzimidazol-2-yl)ethyl]-2-(4-nitro-1H-pyrazol-1-yl)propanamide
CID 5296233
2-(5-methyl-1H-pyrazol-4-yl)-1H-benzimidazole
CID 8002817
N-(2-Pyridin-2-yl-1H-benzoimidazol-5-yl)-acetamide
CID 651000

Frequently Asked Questions

What is the IUPAC name of N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]acetamide?
The IUPAC name of N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]acetamide (CID 135909510) is N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]acetamide.
What is the SMILES notation for N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]acetamide?
The canonical SMILES for N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]acetamide is CC(=O)Nc1cn[nH]c1-c1nc2ccccc2[nH]1.
What is the InChIKey of N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]acetamide?
The InChIKey is LEFKZSWCBZBDLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11N5O/c1-7(18)14-10-6-13-17-11(10)12-15-8-4-2-3-5-9(8)16-12/h2-6H,1H3,(H,13,17)(H,14,18)(H,15,16).
What are the key properties of N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]acetamide?
N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]acetamide has a molecular weight of 241.25 g/mol, XLogP of 1.91, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]acetamide is sourced from PubChem (CID 135909510), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).