N-[2-(furan-2-yl)-2-pyrazol-1-ylethyl]-2,2-diphenylacetamide

C23H21N3O2 — CID 122266052

IUPACN-[2-(furan-2-yl)-2-pyrazol-1-ylethyl]-2,2-diphenylacetamide
SMILESO=C(NCC(c1ccco1)n1cccn1)C(c1ccccc1)c1ccccc1
InChIInChI=1S/C23H21N3O2/c27-23(22(18-9-3-1-4-10-18)19-11-5-2-6-12-19)24-17-20(21-13-7-16-28-21)26-15-8-14-25-26/h1-16,20,22H,17H2,(H,24,27)
InChIKeyNVZRFVFMYVIHIK-UHFFFAOYSA-N
MW371.44 g/mol
LogP4.01
Rot. Bonds7

About N-[2-(furan-2-yl)-2-pyrazol-1-ylethyl]-2,2-diphenylacetamide

N-[2-(furan-2-yl)-2-pyrazol-1-ylethyl]-2,2-diphenylacetamide (PubChem CID 122266052) has the molecular formula C23H21N3O2 and a molecular weight of 371.44 g/mol. Its IUPAC name is N-[2-(furan-2-yl)-2-pyrazol-1-ylethyl]-2,2-diphenylacetamide.

Molecular Properties

Compound NameN-[2-(furan-2-yl)-2-pyrazol-1-ylethyl]-2,2-diphenylacetamide
PubChem CID122266052
Molecular FormulaC23H21N3O2
Molecular Weight371.44 g/mol
Exact Mass371.16
IUPAC NameN-[2-(furan-2-yl)-2-pyrazol-1-ylethyl]-2,2-diphenylacetamide
SMILESO=C(NCC(c1ccco1)n1cccn1)C(c1ccccc1)c1ccccc1
InChIInChI=1S/C23H21N3O2/c27-23(22(18-9-3-1-4-10-18)19-11-5-2-6-12-19)24-17-20(21-13-7-16-28-21)26-15-8-14-25-26/h1-16,20,22H,17H2,(H,24,27)
InChIKeyNVZRFVFMYVIHIK-UHFFFAOYSA-N
XLogP4.01
TPSA60.06 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500371.44
LogP ≤ 54.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]-2,2-diphenylacetamide;hydrochloride
CID 52984942
N-[2-(furan-2-yl)-2-pyrazol-1-ylethyl]-3-methylbutanamide
CID 122265939
N-(furan-2-ylmethyl)-N'-[2-(furan-2-yl)-2-pyrazol-1-ylethyl]oxamide
CID 122266212
N-[2-(furan-2-yl)-2-pyrazol-1-ylethyl]cyclopentanecarboxamide
CID 122265941
2,6-difluoro-N-[2-(furan-2-yl)-2-pyrazol-1-ylethyl]benzamide
CID 122265973
1-[2-(furan-2-yl)-2-pyrazol-1-ylethyl]-3-(2-methoxyphenyl)urea
CID 122266298
N-[2-(furan-2-yl)-2-pyrazol-1-ylethyl]cyclohexanecarboxamide
CID 122265946
2-ethoxy-N-[2-(furan-2-yl)-2-pyrazol-1-ylethyl]acetamide
CID 122265940
N'-(2-chlorophenyl)-N-[2-(furan-2-yl)-2-pyrazol-1-ylethyl]oxamide
CID 119102102
N-[2-(furan-2-yl)-2-pyrazol-1-ylethyl]oxane-4-carboxamide
CID 121019365
N-[2-(furan-2-yl)-2-pyrazol-1-ylethyl]-N'-(4-methylphenyl)oxamide
CID 122266215
2-cyclohexyl-N-[2-(furan-2-yl)-2-pyrazol-1-ylethyl]acetamide
CID 122265953

Frequently Asked Questions

What is the IUPAC name of N-[2-(furan-2-yl)-2-pyrazol-1-ylethyl]-2,2-diphenylacetamide?
The IUPAC name of N-[2-(furan-2-yl)-2-pyrazol-1-ylethyl]-2,2-diphenylacetamide (CID 122266052) is N-[2-(furan-2-yl)-2-pyrazol-1-ylethyl]-2,2-diphenylacetamide.
What is the SMILES notation for N-[2-(furan-2-yl)-2-pyrazol-1-ylethyl]-2,2-diphenylacetamide?
The canonical SMILES for N-[2-(furan-2-yl)-2-pyrazol-1-ylethyl]-2,2-diphenylacetamide is O=C(NCC(c1ccco1)n1cccn1)C(c1ccccc1)c1ccccc1.
What is the InChIKey of N-[2-(furan-2-yl)-2-pyrazol-1-ylethyl]-2,2-diphenylacetamide?
The InChIKey is NVZRFVFMYVIHIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H21N3O2/c27-23(22(18-9-3-1-4-10-18)19-11-5-2-6-12-19)24-17-20(21-13-7-16-28-21)26-15-8-14-25-26/h1-16,20,22H,17H2,(H,24,27).
What are the key properties of N-[2-(furan-2-yl)-2-pyrazol-1-ylethyl]-2,2-diphenylacetamide?
N-[2-(furan-2-yl)-2-pyrazol-1-ylethyl]-2,2-diphenylacetamide has a molecular weight of 371.44 g/mol, XLogP of 4.01, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(furan-2-yl)-2-pyrazol-1-ylethyl]-2,2-diphenylacetamide is sourced from PubChem (CID 122266052), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).