2-[1-(4-fluorophenyl)pyrazol-3-yl]-N-[2-(furan-2-yl)-2-hydroxyethyl]acetamide

C17H16FN3O3 — CID 71991457

IUPAC2-[1-(4-fluorophenyl)pyrazol-3-yl]-N-[2-(furan-2-yl)-2-hydroxyethyl]acetamide
SMILESO=C(Cc1ccn(-c2ccc(F)cc2)n1)NCC(O)c1ccco1
InChIInChI=1S/C17H16FN3O3/c18-12-3-5-14(6-4-12)21-8-7-13(20-21)10-17(23)19-11-15(22)16-2-1-9-24-16/h1-9,15,22H,10-11H2,(H,19,23)
InChIKeyANOOOECNKPVONS-UHFFFAOYSA-N
MW329.33 g/mol
LogP2.00
Rot. Bonds6

About 2-[1-(4-fluorophenyl)pyrazol-3-yl]-N-[2-(furan-2-yl)-2-hydroxyethyl]acetamide

2-[1-(4-fluorophenyl)pyrazol-3-yl]-N-[2-(furan-2-yl)-2-hydroxyethyl]acetamide (PubChem CID 71991457) has the molecular formula C17H16FN3O3 and a molecular weight of 329.33 g/mol. Its IUPAC name is 2-[1-(4-fluorophenyl)pyrazol-3-yl]-N-[2-(furan-2-yl)-2-hydroxyethyl]acetamide.

Molecular Properties

Compound Name2-[1-(4-fluorophenyl)pyrazol-3-yl]-N-[2-(furan-2-yl)-2-hydroxyethyl]acetamide
PubChem CID71991457
Molecular FormulaC17H16FN3O3
Molecular Weight329.33 g/mol
Exact Mass329.12
IUPAC Name2-[1-(4-fluorophenyl)pyrazol-3-yl]-N-[2-(furan-2-yl)-2-hydroxyethyl]acetamide
SMILESO=C(Cc1ccn(-c2ccc(F)cc2)n1)NCC(O)c1ccco1
InChIInChI=1S/C17H16FN3O3/c18-12-3-5-14(6-4-12)21-8-7-13(20-21)10-17(23)19-11-15(22)16-2-1-9-24-16/h1-9,15,22H,10-11H2,(H,19,23)
InChIKeyANOOOECNKPVONS-UHFFFAOYSA-N
XLogP2.00
TPSA80.29 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.33
LogP ≤ 52.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(2-ethyl-2-hydroxybutyl)-2-[1-(4-fluorophenyl)pyrazol-3-yl]acetamide
CID 111483266
N-[[1-(4-fluorophenyl)pyrazol-3-yl]methyl]-2-(furan-2-ylmethylcarbamoylamino)acetamide
CID 167973545
2-[1-(4-fluorophenyl)pyrazol-3-yl]-N-[2-(pyridin-2-ylamino)ethyl]acetamide
CID 71991492
N-[2-(furan-2-yl)-2-hydroxyethyl]-1-(2-phenylethyl)pyrrole-2-carboxamide
CID 110912943
N-[2-(furan-2-yl)-2-hydroxyethyl]-2-[2-oxo-3-(trifluoromethyl)-1-pyridinyl]acetamide
CID 110889033
2-(5-fluoro-2-methyl-1H-indol-3-yl)-N-[2-(furan-2-yl)-2-hydroxyethyl]acetamide
CID 110889006
2-[1-(4-fluorophenyl)pyrazol-3-yl]-N-(2,4,5-trimethylpyrazol-3-yl)acetamide
CID 71873510
1-(4-fluorophenyl)-N-[1-(furan-2-yl)-2-hydroxyethyl]-4-hydroxypyrazole-3-carboxamide
CID 110004135
2-(3,5-dimethyl-1-phenylpyrazol-4-yl)-N-[2-(furan-2-yl)-2-hydroxyethyl]acetamide
CID 56891070
N-[(4,4-difluoro-2-methylpyrrolidin-2-yl)methyl]-2-[1-(4-fluorophenyl)pyrazol-3-yl]acetamide
CID 166286555
4-[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]-N-[2-(furan-2-yl)-2-hydroxyethyl]butanamide
CID 78872121
N-[2-(furan-2-yl)-2-hydroxyethyl]-1-phenyltriazole-4-carboxamide
CID 110888994

Frequently Asked Questions

What is the IUPAC name of 2-[1-(4-fluorophenyl)pyrazol-3-yl]-N-[2-(furan-2-yl)-2-hydroxyethyl]acetamide?
The IUPAC name of 2-[1-(4-fluorophenyl)pyrazol-3-yl]-N-[2-(furan-2-yl)-2-hydroxyethyl]acetamide (CID 71991457) is 2-[1-(4-fluorophenyl)pyrazol-3-yl]-N-[2-(furan-2-yl)-2-hydroxyethyl]acetamide.
What is the SMILES notation for 2-[1-(4-fluorophenyl)pyrazol-3-yl]-N-[2-(furan-2-yl)-2-hydroxyethyl]acetamide?
The canonical SMILES for 2-[1-(4-fluorophenyl)pyrazol-3-yl]-N-[2-(furan-2-yl)-2-hydroxyethyl]acetamide is O=C(Cc1ccn(-c2ccc(F)cc2)n1)NCC(O)c1ccco1.
What is the InChIKey of 2-[1-(4-fluorophenyl)pyrazol-3-yl]-N-[2-(furan-2-yl)-2-hydroxyethyl]acetamide?
The InChIKey is ANOOOECNKPVONS-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16FN3O3/c18-12-3-5-14(6-4-12)21-8-7-13(20-21)10-17(23)19-11-15(22)16-2-1-9-24-16/h1-9,15,22H,10-11H2,(H,19,23).
What are the key properties of 2-[1-(4-fluorophenyl)pyrazol-3-yl]-N-[2-(furan-2-yl)-2-hydroxyethyl]acetamide?
2-[1-(4-fluorophenyl)pyrazol-3-yl]-N-[2-(furan-2-yl)-2-hydroxyethyl]acetamide has a molecular weight of 329.33 g/mol, XLogP of 2.00, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(4-fluorophenyl)pyrazol-3-yl]-N-[2-(furan-2-yl)-2-hydroxyethyl]acetamide is sourced from PubChem (CID 71991457), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).