N-(2-cyclopentylpyrazol-3-yl)-4-imidazol-1-ylbenzamide

C18H19N5O — CID 134707115

IUPACN-(2-cyclopentylpyrazol-3-yl)-4-imidazol-1-ylbenzamide
SMILESO=C(Nc1ccnn1C1CCCC1)c1ccc(-n2ccnc2)cc1
InChIInChI=1S/C18H19N5O/c24-18(14-5-7-15(8-6-14)22-12-11-19-13-22)21-17-9-10-20-23(17)16-3-1-2-4-16/h5-13,16H,1-4H2,(H,21,24)
InChIKeyBCWIJDBXMIVUPR-UHFFFAOYSA-N
MW321.38 g/mol
LogP3.44
Rot. Bonds4

About N-(2-cyclopentylpyrazol-3-yl)-4-imidazol-1-ylbenzamide

N-(2-cyclopentylpyrazol-3-yl)-4-imidazol-1-ylbenzamide (PubChem CID 134707115) has the molecular formula C18H19N5O and a molecular weight of 321.38 g/mol. Its IUPAC name is N-(2-cyclopentylpyrazol-3-yl)-4-imidazol-1-ylbenzamide.

Molecular Properties

Compound NameN-(2-cyclopentylpyrazol-3-yl)-4-imidazol-1-ylbenzamide
PubChem CID134707115
Molecular FormulaC18H19N5O
Molecular Weight321.38 g/mol
Exact Mass321.16
IUPAC NameN-(2-cyclopentylpyrazol-3-yl)-4-imidazol-1-ylbenzamide
SMILESO=C(Nc1ccnn1C1CCCC1)c1ccc(-n2ccnc2)cc1
InChIInChI=1S/C18H19N5O/c24-18(14-5-7-15(8-6-14)22-12-11-19-13-22)21-17-9-10-20-23(17)16-3-1-2-4-16/h5-13,16H,1-4H2,(H,21,24)
InChIKeyBCWIJDBXMIVUPR-UHFFFAOYSA-N
XLogP3.44
TPSA64.74 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.38
LogP ≤ 53.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

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CID 51145829
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CID 51192351
N-[2-(1,1-dioxothiolan-3-yl)-5-methylpyrazol-3-yl]-4-imidazol-1-ylbenzamide
CID 47785451
N-[2-(1-cyclohexylpiperidin-4-yl)pyrazol-3-yl]benzamide
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N-(2-cyclohexylpyrazol-3-yl)-3-fluoro-4-methylbenzamide
CID 51231002
N-[2-(1-cyclopentylpiperidin-4-yl)pyrazol-3-yl]pyridine-3-carboxamide
CID 25294061
4-imidazol-1-yl-N-[[(2R)-oxolan-2-yl]methyl]benzamide
CID 31532997
4-imidazol-1-yl-N-[[(2S)-oxolan-2-yl]methyl]benzamide
CID 31532996
N-(3-cyclopentylpropyl)-4-imidazol-1-ylbenzamide
CID 38336531
N-[2-(1-cyclobutylpiperidin-4-yl)pyrazol-3-yl]-4-methoxybenzamide
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CID 78807034

Frequently Asked Questions

What is the IUPAC name of N-(2-cyclopentylpyrazol-3-yl)-4-imidazol-1-ylbenzamide?
The IUPAC name of N-(2-cyclopentylpyrazol-3-yl)-4-imidazol-1-ylbenzamide (CID 134707115) is N-(2-cyclopentylpyrazol-3-yl)-4-imidazol-1-ylbenzamide.
What is the SMILES notation for N-(2-cyclopentylpyrazol-3-yl)-4-imidazol-1-ylbenzamide?
The canonical SMILES for N-(2-cyclopentylpyrazol-3-yl)-4-imidazol-1-ylbenzamide is O=C(Nc1ccnn1C1CCCC1)c1ccc(-n2ccnc2)cc1.
What is the InChIKey of N-(2-cyclopentylpyrazol-3-yl)-4-imidazol-1-ylbenzamide?
The InChIKey is BCWIJDBXMIVUPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19N5O/c24-18(14-5-7-15(8-6-14)22-12-11-19-13-22)21-17-9-10-20-23(17)16-3-1-2-4-16/h5-13,16H,1-4H2,(H,21,24).
What are the key properties of N-(2-cyclopentylpyrazol-3-yl)-4-imidazol-1-ylbenzamide?
N-(2-cyclopentylpyrazol-3-yl)-4-imidazol-1-ylbenzamide has a molecular weight of 321.38 g/mol, XLogP of 3.44, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyclopentylpyrazol-3-yl)-4-imidazol-1-ylbenzamide is sourced from PubChem (CID 134707115), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).