5-acetamido-N-[2-(5-methylfuran-2-yl)ethyl]-1-phenylpyrazole-3-carboxamide

C19H20N4O3 — CID 51999490

IUPAC5-acetamido-N-[2-(5-methylfuran-2-yl)ethyl]-1-phenylpyrazole-3-carboxamide
SMILESCC(=O)Nc1cc(C(=O)NCCc2ccc(C)o2)nn1-c1ccccc1
InChIInChI=1S/C19H20N4O3/c1-13-8-9-16(26-13)10-11-20-19(25)17-12-18(21-14(2)24)23(22-17)15-6-4-3-5-7-15/h3-9,12H,10-11H2,1-2H3,(H,20,25)(H,21,24)
InChIKeyQZIYRUAOFNCHIZ-UHFFFAOYSA-N
MW352.39 g/mol
LogP2.70
Rot. Bonds6

About 5-acetamido-N-[2-(5-methylfuran-2-yl)ethyl]-1-phenylpyrazole-3-carboxamide

5-acetamido-N-[2-(5-methylfuran-2-yl)ethyl]-1-phenylpyrazole-3-carboxamide (PubChem CID 51999490) has the molecular formula C19H20N4O3 and a molecular weight of 352.39 g/mol. Its IUPAC name is 5-acetamido-N-[2-(5-methylfuran-2-yl)ethyl]-1-phenylpyrazole-3-carboxamide.

Molecular Properties

Compound Name5-acetamido-N-[2-(5-methylfuran-2-yl)ethyl]-1-phenylpyrazole-3-carboxamide
PubChem CID51999490
Molecular FormulaC19H20N4O3
Molecular Weight352.39 g/mol
Exact Mass352.15
IUPAC Name5-acetamido-N-[2-(5-methylfuran-2-yl)ethyl]-1-phenylpyrazole-3-carboxamide
SMILESCC(=O)Nc1cc(C(=O)NCCc2ccc(C)o2)nn1-c1ccccc1
InChIInChI=1S/C19H20N4O3/c1-13-8-9-16(26-13)10-11-20-19(25)17-12-18(21-14(2)24)23(22-17)15-6-4-3-5-7-15/h3-9,12H,10-11H2,1-2H3,(H,20,25)(H,21,24)
InChIKeyQZIYRUAOFNCHIZ-UHFFFAOYSA-N
XLogP2.70
TPSA89.16 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.39
LogP ≤ 52.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

5-acetamido-N-[3-(3,5-dimethylpyrazol-1-yl)propyl]-1-phenylpyrazole-3-carboxamide
CID 51999451
5-acetamido-N-tert-butyl-1-phenylpyrazole-3-carboxamide
CID 51999377
5-acetamido-N-[(3-fluorophenyl)methyl]-1-phenylpyrazole-3-carboxamide
CID 51999472
N-[2-(1,3-benzodioxol-5-yl)ethyl]-5-(2-methylpropanoylamino)-1-phenylpyrazole-3-carboxamide
CID 51998508
ethyl 4-[(5-acetamido-1-phenylpyrazole-3-carbonyl)amino]benzoate
CID 51999347
5-(cyclopropanecarbonylamino)-N-[2-(4-methoxyphenyl)ethyl]-1-phenylpyrazole-3-carboxamide
CID 51998610
N-[2-(benzimidazol-1-yl)ethyl]-5-(2-methylpropanoylamino)-1-phenylpyrazole-3-carboxamide
CID 51998470
N-[2-(furan-2-yl)ethyl]-3-(5-methylfuran-2-yl)-1-phenylpyrazole-4-carboxamide
CID 55339723
5-acetamido-N-[1-[(3-methylphenyl)methyl]pyrazol-4-yl]-1-phenylpyrazole-3-carboxamide
CID 51999507
4-methoxy-N-[2-(5-methylfuran-2-yl)ethyl]pyridine-2-carboxamide
CID 91778944
5-acetamido-1-phenyl-N-(4-piperidin-1-ylphenyl)pyrazole-3-carboxamide
CID 51999445
N-[2-(4-methoxyphenoxy)ethyl]-5-methyl-1-phenylpyrazole-3-carboxamide
CID 110372766

Frequently Asked Questions

What is the IUPAC name of 5-acetamido-N-[2-(5-methylfuran-2-yl)ethyl]-1-phenylpyrazole-3-carboxamide?
The IUPAC name of 5-acetamido-N-[2-(5-methylfuran-2-yl)ethyl]-1-phenylpyrazole-3-carboxamide (CID 51999490) is 5-acetamido-N-[2-(5-methylfuran-2-yl)ethyl]-1-phenylpyrazole-3-carboxamide.
What is the SMILES notation for 5-acetamido-N-[2-(5-methylfuran-2-yl)ethyl]-1-phenylpyrazole-3-carboxamide?
The canonical SMILES for 5-acetamido-N-[2-(5-methylfuran-2-yl)ethyl]-1-phenylpyrazole-3-carboxamide is CC(=O)Nc1cc(C(=O)NCCc2ccc(C)o2)nn1-c1ccccc1.
What is the InChIKey of 5-acetamido-N-[2-(5-methylfuran-2-yl)ethyl]-1-phenylpyrazole-3-carboxamide?
The InChIKey is QZIYRUAOFNCHIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N4O3/c1-13-8-9-16(26-13)10-11-20-19(25)17-12-18(21-14(2)24)23(22-17)15-6-4-3-5-7-15/h3-9,12H,10-11H2,1-2H3,(H,20,25)(H,21,24).
What are the key properties of 5-acetamido-N-[2-(5-methylfuran-2-yl)ethyl]-1-phenylpyrazole-3-carboxamide?
5-acetamido-N-[2-(5-methylfuran-2-yl)ethyl]-1-phenylpyrazole-3-carboxamide has a molecular weight of 352.39 g/mol, XLogP of 2.70, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-acetamido-N-[2-(5-methylfuran-2-yl)ethyl]-1-phenylpyrazole-3-carboxamide is sourced from PubChem (CID 51999490), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).