N-(1-ethyl-2-methylbenzimidazol-5-yl)-2-pyrazol-1-ylacetamide

C15H17N5O — CID 46981380

IUPACN-(1-ethyl-2-methylbenzimidazol-5-yl)-2-pyrazol-1-ylacetamide
SMILESCCn1c(C)nc2cc(NC(=O)Cn3cccn3)ccc21
InChIInChI=1S/C15H17N5O/c1-3-20-11(2)17-13-9-12(5-6-14(13)20)18-15(21)10-19-8-4-7-16-19/h4-9H,3,10H2,1-2H3,(H,18,21)
InChIKeyMRQWLUWUXXVPDY-UHFFFAOYSA-N
MW283.33 g/mol
LogP2.20
Rot. Bonds4

About N-(1-ethyl-2-methylbenzimidazol-5-yl)-2-pyrazol-1-ylacetamide

N-(1-ethyl-2-methylbenzimidazol-5-yl)-2-pyrazol-1-ylacetamide (PubChem CID 46981380) has the molecular formula C15H17N5O and a molecular weight of 283.33 g/mol. Its IUPAC name is N-(1-ethyl-2-methylbenzimidazol-5-yl)-2-pyrazol-1-ylacetamide.

Molecular Properties

Compound NameN-(1-ethyl-2-methylbenzimidazol-5-yl)-2-pyrazol-1-ylacetamide
PubChem CID46981380
Molecular FormulaC15H17N5O
Molecular Weight283.33 g/mol
Exact Mass283.14
IUPAC NameN-(1-ethyl-2-methylbenzimidazol-5-yl)-2-pyrazol-1-ylacetamide
SMILESCCn1c(C)nc2cc(NC(=O)Cn3cccn3)ccc21
InChIInChI=1S/C15H17N5O/c1-3-20-11(2)17-13-9-12(5-6-14(13)20)18-15(21)10-19-8-4-7-16-19/h4-9H,3,10H2,1-2H3,(H,18,21)
InChIKeyMRQWLUWUXXVPDY-UHFFFAOYSA-N
XLogP2.20
TPSA64.74 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.33
LogP ≤ 52.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[1-ethyl-2-(pyrazol-1-ylmethyl)benzimidazol-5-yl]butanamide
CID 46263440
1-(3-acetylphenyl)-3-(1-ethyl-2-methylbenzimidazol-5-yl)urea
CID 9267921
N-(3,4-difluorophenyl)-2-pyrazol-1-ylacetamide
CID 39724155
N,N-dimethyl-3-[(2-pyrazol-1-ylacetyl)amino]benzamide
CID 33366231
N-[1-(2-methoxyethyl)-2-(pyrazol-1-ylmethyl)benzimidazol-5-yl]-3-methylbutanamide
CID 35176961
N-(2-methyl-1-propylbenzimidazol-5-yl)-3-pyridin-4-ylpropanamide
CID 131927243
N-(2,3-dimethylquinoxalin-6-yl)-3-pyrazol-1-ylpropanamide
CID 92596027
N-cyclohexyl-1-[2-[(1-ethyl-2-methylbenzimidazol-5-yl)amino]-2-oxoethyl]-6-oxopyridine-3-carboxamide
CID 92635811
N-(6-bromo-3-pyridinyl)-2-pyrazol-1-ylacetamide
CID 103789408
N-(1,2-diethylbenzimidazol-5-yl)-2-(4,6-dimethyl-2-oxopyrimidin-1-yl)acetamide
CID 46971884
N-[4-[[(1-ethyl-2-methylbenzimidazole-5-carbonyl)amino]carbamoyl]phenyl]benzamide
CID 46633272
N-[1-(2-methoxyethyl)-2-(pyrazol-1-ylmethyl)benzimidazol-5-yl]-4-methylbenzamide
CID 35176965

Frequently Asked Questions

What is the IUPAC name of N-(1-ethyl-2-methylbenzimidazol-5-yl)-2-pyrazol-1-ylacetamide?
The IUPAC name of N-(1-ethyl-2-methylbenzimidazol-5-yl)-2-pyrazol-1-ylacetamide (CID 46981380) is N-(1-ethyl-2-methylbenzimidazol-5-yl)-2-pyrazol-1-ylacetamide.
What is the SMILES notation for N-(1-ethyl-2-methylbenzimidazol-5-yl)-2-pyrazol-1-ylacetamide?
The canonical SMILES for N-(1-ethyl-2-methylbenzimidazol-5-yl)-2-pyrazol-1-ylacetamide is CCn1c(C)nc2cc(NC(=O)Cn3cccn3)ccc21.
What is the InChIKey of N-(1-ethyl-2-methylbenzimidazol-5-yl)-2-pyrazol-1-ylacetamide?
The InChIKey is MRQWLUWUXXVPDY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N5O/c1-3-20-11(2)17-13-9-12(5-6-14(13)20)18-15(21)10-19-8-4-7-16-19/h4-9H,3,10H2,1-2H3,(H,18,21).
What are the key properties of N-(1-ethyl-2-methylbenzimidazol-5-yl)-2-pyrazol-1-ylacetamide?
N-(1-ethyl-2-methylbenzimidazol-5-yl)-2-pyrazol-1-ylacetamide has a molecular weight of 283.33 g/mol, XLogP of 2.20, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-ethyl-2-methylbenzimidazol-5-yl)-2-pyrazol-1-ylacetamide is sourced from PubChem (CID 46981380), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).