2-hydroxy-N-[5-(1-methylimidazol-2-yl)-1H-pyrazol-3-yl]-2,2-diphenylacetamide

C21H19N5O2 — CID 166230187

IUPAC2-hydroxy-N-[5-(1-methylimidazol-2-yl)-1H-pyrazol-3-yl]-2,2-diphenylacetamide
SMILESCn1ccnc1-c1cc(NC(=O)C(O)(c2ccccc2)c2ccccc2)n[nH]1
InChIInChI=1S/C21H19N5O2/c1-26-13-12-22-19(26)17-14-18(25-24-17)23-20(27)21(28,15-8-4-2-5-9-15)16-10-6-3-7-11-16/h2-14,28H,1H3,(H2,23,24,25,27)
InChIKeyHXKMWIIYMVEYPB-UHFFFAOYSA-N
MW373.42 g/mol
LogP2.68
Rot. Bonds5

About 2-hydroxy-N-[5-(1-methylimidazol-2-yl)-1H-pyrazol-3-yl]-2,2-diphenylacetamide

2-hydroxy-N-[5-(1-methylimidazol-2-yl)-1H-pyrazol-3-yl]-2,2-diphenylacetamide (PubChem CID 166230187) has the molecular formula C21H19N5O2 and a molecular weight of 373.42 g/mol. Its IUPAC name is 2-hydroxy-N-[5-(1-methylimidazol-2-yl)-1H-pyrazol-3-yl]-2,2-diphenylacetamide.

Molecular Properties

Compound Name2-hydroxy-N-[5-(1-methylimidazol-2-yl)-1H-pyrazol-3-yl]-2,2-diphenylacetamide
PubChem CID166230187
Molecular FormulaC21H19N5O2
Molecular Weight373.42 g/mol
Exact Mass373.15
IUPAC Name2-hydroxy-N-[5-(1-methylimidazol-2-yl)-1H-pyrazol-3-yl]-2,2-diphenylacetamide
SMILESCn1ccnc1-c1cc(NC(=O)C(O)(c2ccccc2)c2ccccc2)n[nH]1
InChIInChI=1S/C21H19N5O2/c1-26-13-12-22-19(26)17-14-18(25-24-17)23-20(27)21(28,15-8-4-2-5-9-15)16-10-6-3-7-11-16/h2-14,28H,1H3,(H2,23,24,25,27)
InChIKeyHXKMWIIYMVEYPB-UHFFFAOYSA-N
XLogP2.68
TPSA95.83 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.42
LogP ≤ 52.68
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-N-[5-(1-methylimidazol-2-yl)-1H-pyrazol-3-yl]-2,2-diphenylacetamide?
The IUPAC name of 2-hydroxy-N-[5-(1-methylimidazol-2-yl)-1H-pyrazol-3-yl]-2,2-diphenylacetamide (CID 166230187) is 2-hydroxy-N-[5-(1-methylimidazol-2-yl)-1H-pyrazol-3-yl]-2,2-diphenylacetamide.
What is the SMILES notation for 2-hydroxy-N-[5-(1-methylimidazol-2-yl)-1H-pyrazol-3-yl]-2,2-diphenylacetamide?
The canonical SMILES for 2-hydroxy-N-[5-(1-methylimidazol-2-yl)-1H-pyrazol-3-yl]-2,2-diphenylacetamide is Cn1ccnc1-c1cc(NC(=O)C(O)(c2ccccc2)c2ccccc2)n[nH]1.
What is the InChIKey of 2-hydroxy-N-[5-(1-methylimidazol-2-yl)-1H-pyrazol-3-yl]-2,2-diphenylacetamide?
The InChIKey is HXKMWIIYMVEYPB-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H19N5O2/c1-26-13-12-22-19(26)17-14-18(25-24-17)23-20(27)21(28,15-8-4-2-5-9-15)16-10-6-3-7-11-16/h2-14,28H,1H3,(H2,23,24,25,27).
What are the key properties of 2-hydroxy-N-[5-(1-methylimidazol-2-yl)-1H-pyrazol-3-yl]-2,2-diphenylacetamide?
2-hydroxy-N-[5-(1-methylimidazol-2-yl)-1H-pyrazol-3-yl]-2,2-diphenylacetamide has a molecular weight of 373.42 g/mol, XLogP of 2.68, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-N-[5-(1-methylimidazol-2-yl)-1H-pyrazol-3-yl]-2,2-diphenylacetamide is sourced from PubChem (CID 166230187), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).