2-(benzimidazol-1-yl)-N-[1-(1H-pyrazol-4-yl)ethyl]propanamide

C15H17N5O — CID 103855843

IUPAC2-(benzimidazol-1-yl)-N-[1-(1H-pyrazol-4-yl)ethyl]propanamide
SMILESCC(NC(=O)C(C)n1cnc2ccccc21)c1cn[nH]c1
InChIInChI=1S/C15H17N5O/c1-10(12-7-17-18-8-12)19-15(21)11(2)20-9-16-13-5-3-4-6-14(13)20/h3-11H,1-2H3,(H,17,18)(H,19,21)
InChIKeyUJLDVBQXHXVPPB-UHFFFAOYSA-N
MW283.33 g/mol
LogP2.20
Rot. Bonds4

About 2-(benzimidazol-1-yl)-N-[1-(1H-pyrazol-4-yl)ethyl]propanamide

2-(benzimidazol-1-yl)-N-[1-(1H-pyrazol-4-yl)ethyl]propanamide (PubChem CID 103855843) has the molecular formula C15H17N5O and a molecular weight of 283.33 g/mol. Its IUPAC name is 2-(benzimidazol-1-yl)-N-[1-(1H-pyrazol-4-yl)ethyl]propanamide.

Molecular Properties

Compound Name2-(benzimidazol-1-yl)-N-[1-(1H-pyrazol-4-yl)ethyl]propanamide
PubChem CID103855843
Molecular FormulaC15H17N5O
Molecular Weight283.33 g/mol
Exact Mass283.14
IUPAC Name2-(benzimidazol-1-yl)-N-[1-(1H-pyrazol-4-yl)ethyl]propanamide
SMILESCC(NC(=O)C(C)n1cnc2ccccc21)c1cn[nH]c1
InChIInChI=1S/C15H17N5O/c1-10(12-7-17-18-8-12)19-15(21)11(2)20-9-16-13-5-3-4-6-14(13)20/h3-11H,1-2H3,(H,17,18)(H,19,21)
InChIKeyUJLDVBQXHXVPPB-UHFFFAOYSA-N
XLogP2.20
TPSA75.60 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.33
LogP ≤ 52.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-benzhydryl-2-(benzimidazol-1-yl)propanamide
CID 112781098
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(2S)-2-(benzimidazol-1-yl)-N-[(1R)-1-(2,4-dimethyl-1,3-thiazol-5-yl)ethyl]propanamide
CID 95142229
(2S)-2-(benzimidazol-1-yl)-N-[(1S)-1-(2,4-dimethyl-1,3-thiazol-5-yl)ethyl]propanamide
CID 95142230
(2R)-2-(benzimidazol-1-yl)-N-[(S)-phenyl(thiophen-2-yl)methyl]propanamide
CID 39059871
(2R)-2-(benzimidazol-1-yl)-N-[(R)-phenyl(1,3-thiazol-2-yl)methyl]propanamide
CID 99804213
2-[2-(benzimidazol-1-yl)propanoylamino]-2-cyclopropylacetic acid
CID 62697653
(2S)-2-(benzimidazol-1-yl)-N-(4-oxo-1H-pyridin-3-yl)propanamide
CID 94151702
(2S)-2-(benzimidazol-1-yl)-N-prop-2-enylpropanamide
CID 39041110
2-cyano-2-phenyl-N-[1-(1H-pyrazol-4-yl)ethyl]acetamide
CID 106213471
N-[2-[2-(benzimidazol-1-yl)propanoylamino]ethyl]benzamide
CID 42959454
(2S)-2-amino-3-phenyl-N-[1-(1H-pyrazol-4-yl)ethyl]propanamide
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Frequently Asked Questions

What is the IUPAC name of 2-(benzimidazol-1-yl)-N-[1-(1H-pyrazol-4-yl)ethyl]propanamide?
The IUPAC name of 2-(benzimidazol-1-yl)-N-[1-(1H-pyrazol-4-yl)ethyl]propanamide (CID 103855843) is 2-(benzimidazol-1-yl)-N-[1-(1H-pyrazol-4-yl)ethyl]propanamide.
What is the SMILES notation for 2-(benzimidazol-1-yl)-N-[1-(1H-pyrazol-4-yl)ethyl]propanamide?
The canonical SMILES for 2-(benzimidazol-1-yl)-N-[1-(1H-pyrazol-4-yl)ethyl]propanamide is CC(NC(=O)C(C)n1cnc2ccccc21)c1cn[nH]c1.
What is the InChIKey of 2-(benzimidazol-1-yl)-N-[1-(1H-pyrazol-4-yl)ethyl]propanamide?
The InChIKey is UJLDVBQXHXVPPB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N5O/c1-10(12-7-17-18-8-12)19-15(21)11(2)20-9-16-13-5-3-4-6-14(13)20/h3-11H,1-2H3,(H,17,18)(H,19,21).
What are the key properties of 2-(benzimidazol-1-yl)-N-[1-(1H-pyrazol-4-yl)ethyl]propanamide?
2-(benzimidazol-1-yl)-N-[1-(1H-pyrazol-4-yl)ethyl]propanamide has a molecular weight of 283.33 g/mol, XLogP of 2.20, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(benzimidazol-1-yl)-N-[1-(1H-pyrazol-4-yl)ethyl]propanamide is sourced from PubChem (CID 103855843), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).