N-[2-[4-(4-fluorophenyl)-3-(1-methylimidazol-2-yl)pyrazol-1-yl]ethyl]-2-(4-methylphenyl)acetamide

C24H24FN5O — CID 92557814

IUPACN-[2-[4-(4-fluorophenyl)-3-(1-methylimidazol-2-yl)pyrazol-1-yl]ethyl]-2-(4-methylphenyl)acetamide
SMILESCc1ccc(CC(=O)NCCn2cc(-c3ccc(F)cc3)c(-c3nccn3C)n2)cc1
InChIInChI=1S/C24H24FN5O/c1-17-3-5-18(6-4-17)15-22(31)26-12-14-30-16-21(19-7-9-20(25)10-8-19)23(28-30)24-27-11-13-29(24)2/h3-11,13,16H,12,14-15H2,1-2H3,(H,26,31)
InChIKeyUXPOWADVOMBIDQ-UHFFFAOYSA-N
MW417.49 g/mol
LogP3.76
Rot. Bonds7

About N-[2-[4-(4-fluorophenyl)-3-(1-methylimidazol-2-yl)pyrazol-1-yl]ethyl]-2-(4-methylphenyl)acetamide

N-[2-[4-(4-fluorophenyl)-3-(1-methylimidazol-2-yl)pyrazol-1-yl]ethyl]-2-(4-methylphenyl)acetamide (PubChem CID 92557814) has the molecular formula C24H24FN5O and a molecular weight of 417.49 g/mol. Its IUPAC name is N-[2-[4-(4-fluorophenyl)-3-(1-methylimidazol-2-yl)pyrazol-1-yl]ethyl]-2-(4-methylphenyl)acetamide.

Molecular Properties

Compound NameN-[2-[4-(4-fluorophenyl)-3-(1-methylimidazol-2-yl)pyrazol-1-yl]ethyl]-2-(4-methylphenyl)acetamide
PubChem CID92557814
Molecular FormulaC24H24FN5O
Molecular Weight417.49 g/mol
Exact Mass417.20
IUPAC NameN-[2-[4-(4-fluorophenyl)-3-(1-methylimidazol-2-yl)pyrazol-1-yl]ethyl]-2-(4-methylphenyl)acetamide
SMILESCc1ccc(CC(=O)NCCn2cc(-c3ccc(F)cc3)c(-c3nccn3C)n2)cc1
InChIInChI=1S/C24H24FN5O/c1-17-3-5-18(6-4-17)15-22(31)26-12-14-30-16-21(19-7-9-20(25)10-8-19)23(28-30)24-27-11-13-29(24)2/h3-11,13,16H,12,14-15H2,1-2H3,(H,26,31)
InChIKeyUXPOWADVOMBIDQ-UHFFFAOYSA-N
XLogP3.76
TPSA64.74 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500417.49
LogP ≤ 53.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[2-[4-(4-fluorophenyl)-3-(1-methylimidazol-2-yl)pyrazol-1-yl]ethyl]-2-pyridin-3-ylacetamide
CID 95850905
N-[2-[4-(4-fluorophenyl)-3-(1-methylimidazol-2-yl)pyrazol-1-yl]ethyl]-2-(2-methoxy-5-methylphenyl)acetamide
CID 92556179
N-[2-[4-(4-chlorophenyl)-3-(1-methylimidazol-2-yl)pyrazol-1-yl]ethyl]-2-methoxyacetamide
CID 92567455
2-(4-fluorophenyl)-N-[3-(4-methylphenyl)propyl]acetamide
CID 100706292
N-[3-(4-fluorophenyl)propyl]-2-(4-methylphenyl)acetamide
CID 92684324
N-[2-[4-(4-fluorophenyl)-5-(1-methylimidazol-2-yl)pyrazol-1-yl]ethyl]-2-(2-methoxyphenyl)acetamide
CID 92567615
2-(4-fluorophenyl)-N-(1-methylimidazol-2-yl)acetamide
CID 110472886
2-(1-methylimidazol-2-yl)-N-[(4-methylphenyl)methyl]acetamide
CID 110474600
N-[2-[[(S)-(4-fluorophenyl)-(1-methylimidazol-2-yl)methyl]amino]-2-oxoethyl]-4-methylbenzamide
CID 25358357
N-[2-[4-(4-chlorophenyl)-5-(1-methylimidazol-2-yl)pyrazol-1-yl]ethyl]-2-pyridin-3-ylacetamide
CID 95850915
2-(4-chlorophenyl)-N-[2-(1-methylimidazol-2-yl)ethyl]acetamide
CID 110476101
N-[2-(1-methylbenzimidazol-5-yl)ethyl]-2-(4-methylphenyl)acetamide
CID 110791656

Frequently Asked Questions

What is the IUPAC name of N-[2-[4-(4-fluorophenyl)-3-(1-methylimidazol-2-yl)pyrazol-1-yl]ethyl]-2-(4-methylphenyl)acetamide?
The IUPAC name of N-[2-[4-(4-fluorophenyl)-3-(1-methylimidazol-2-yl)pyrazol-1-yl]ethyl]-2-(4-methylphenyl)acetamide (CID 92557814) is N-[2-[4-(4-fluorophenyl)-3-(1-methylimidazol-2-yl)pyrazol-1-yl]ethyl]-2-(4-methylphenyl)acetamide.
What is the SMILES notation for N-[2-[4-(4-fluorophenyl)-3-(1-methylimidazol-2-yl)pyrazol-1-yl]ethyl]-2-(4-methylphenyl)acetamide?
The canonical SMILES for N-[2-[4-(4-fluorophenyl)-3-(1-methylimidazol-2-yl)pyrazol-1-yl]ethyl]-2-(4-methylphenyl)acetamide is Cc1ccc(CC(=O)NCCn2cc(-c3ccc(F)cc3)c(-c3nccn3C)n2)cc1.
What is the InChIKey of N-[2-[4-(4-fluorophenyl)-3-(1-methylimidazol-2-yl)pyrazol-1-yl]ethyl]-2-(4-methylphenyl)acetamide?
The InChIKey is UXPOWADVOMBIDQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H24FN5O/c1-17-3-5-18(6-4-17)15-22(31)26-12-14-30-16-21(19-7-9-20(25)10-8-19)23(28-30)24-27-11-13-29(24)2/h3-11,13,16H,12,14-15H2,1-2H3,(H,26,31).
What are the key properties of N-[2-[4-(4-fluorophenyl)-3-(1-methylimidazol-2-yl)pyrazol-1-yl]ethyl]-2-(4-methylphenyl)acetamide?
N-[2-[4-(4-fluorophenyl)-3-(1-methylimidazol-2-yl)pyrazol-1-yl]ethyl]-2-(4-methylphenyl)acetamide has a molecular weight of 417.49 g/mol, XLogP of 3.76, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[4-(4-fluorophenyl)-3-(1-methylimidazol-2-yl)pyrazol-1-yl]ethyl]-2-(4-methylphenyl)acetamide is sourced from PubChem (CID 92557814), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).