N-(2-cyclohexylpyrazol-3-yl)-2-(2-methylimidazol-1-yl)acetamide

C15H21N5O — CID 46997255

IUPACN-(2-cyclohexylpyrazol-3-yl)-2-(2-methylimidazol-1-yl)acetamide
SMILESCc1nccn1CC(=O)Nc1ccnn1C1CCCCC1
InChIInChI=1S/C15H21N5O/c1-12-16-9-10-19(12)11-15(21)18-14-7-8-17-20(14)13-5-3-2-4-6-13/h7-10,13H,2-6,11H2,1H3,(H,18,21)
InChIKeyKHNUGFJFMLCCDT-UHFFFAOYSA-N
MW287.37 g/mol
LogP2.53
Rot. Bonds4

About N-(2-cyclohexylpyrazol-3-yl)-2-(2-methylimidazol-1-yl)acetamide

N-(2-cyclohexylpyrazol-3-yl)-2-(2-methylimidazol-1-yl)acetamide (PubChem CID 46997255) has the molecular formula C15H21N5O and a molecular weight of 287.37 g/mol. Its IUPAC name is N-(2-cyclohexylpyrazol-3-yl)-2-(2-methylimidazol-1-yl)acetamide.

Molecular Properties

Compound NameN-(2-cyclohexylpyrazol-3-yl)-2-(2-methylimidazol-1-yl)acetamide
PubChem CID46997255
Molecular FormulaC15H21N5O
Molecular Weight287.37 g/mol
Exact Mass287.17
IUPAC NameN-(2-cyclohexylpyrazol-3-yl)-2-(2-methylimidazol-1-yl)acetamide
SMILESCc1nccn1CC(=O)Nc1ccnn1C1CCCCC1
InChIInChI=1S/C15H21N5O/c1-12-16-9-10-19(12)11-15(21)18-14-7-8-17-20(14)13-5-3-2-4-6-13/h7-10,13H,2-6,11H2,1H3,(H,18,21)
InChIKeyKHNUGFJFMLCCDT-UHFFFAOYSA-N
XLogP2.53
TPSA64.74 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.37
LogP ≤ 52.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of N-(2-cyclohexylpyrazol-3-yl)-2-(2-methylimidazol-1-yl)acetamide?
The IUPAC name of N-(2-cyclohexylpyrazol-3-yl)-2-(2-methylimidazol-1-yl)acetamide (CID 46997255) is N-(2-cyclohexylpyrazol-3-yl)-2-(2-methylimidazol-1-yl)acetamide.
What is the SMILES notation for N-(2-cyclohexylpyrazol-3-yl)-2-(2-methylimidazol-1-yl)acetamide?
The canonical SMILES for N-(2-cyclohexylpyrazol-3-yl)-2-(2-methylimidazol-1-yl)acetamide is Cc1nccn1CC(=O)Nc1ccnn1C1CCCCC1.
What is the InChIKey of N-(2-cyclohexylpyrazol-3-yl)-2-(2-methylimidazol-1-yl)acetamide?
The InChIKey is KHNUGFJFMLCCDT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N5O/c1-12-16-9-10-19(12)11-15(21)18-14-7-8-17-20(14)13-5-3-2-4-6-13/h7-10,13H,2-6,11H2,1H3,(H,18,21).
What are the key properties of N-(2-cyclohexylpyrazol-3-yl)-2-(2-methylimidazol-1-yl)acetamide?
N-(2-cyclohexylpyrazol-3-yl)-2-(2-methylimidazol-1-yl)acetamide has a molecular weight of 287.37 g/mol, XLogP of 2.53, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyclohexylpyrazol-3-yl)-2-(2-methylimidazol-1-yl)acetamide is sourced from PubChem (CID 46997255), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).