2-[5-(furan-2-yl)-1H-pyrazol-3-yl]benzamide

C14H11N3O2 — CID 130376801

IUPAC2-[5-(furan-2-yl)-1H-pyrazol-3-yl]benzamide
SMILESNC(=O)c1ccccc1-c1cc(-c2ccco2)[nH]n1
InChIInChI=1S/C14H11N3O2/c15-14(18)10-5-2-1-4-9(10)11-8-12(17-16-11)13-6-3-7-19-13/h1-8H,(H2,15,18)(H,16,17)
InChIKeyIZWXWAJFWXNSSE-UHFFFAOYSA-N
MW253.26 g/mol
LogP2.44
Rot. Bonds3

About 2-[5-(furan-2-yl)-1H-pyrazol-3-yl]benzamide

2-[5-(furan-2-yl)-1H-pyrazol-3-yl]benzamide (PubChem CID 130376801) has the molecular formula C14H11N3O2 and a molecular weight of 253.26 g/mol. Its IUPAC name is 2-[5-(furan-2-yl)-1H-pyrazol-3-yl]benzamide.

Molecular Properties

Compound Name2-[5-(furan-2-yl)-1H-pyrazol-3-yl]benzamide
PubChem CID130376801
Molecular FormulaC14H11N3O2
Molecular Weight253.26 g/mol
Exact Mass253.09
IUPAC Name2-[5-(furan-2-yl)-1H-pyrazol-3-yl]benzamide
SMILESNC(=O)c1ccccc1-c1cc(-c2ccco2)[nH]n1
InChIInChI=1S/C14H11N3O2/c15-14(18)10-5-2-1-4-9(10)11-8-12(17-16-11)13-6-3-7-19-13/h1-8H,(H2,15,18)(H,16,17)
InChIKeyIZWXWAJFWXNSSE-UHFFFAOYSA-N
XLogP2.44
TPSA84.91 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.26
LogP ≤ 52.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[5-(furan-2-yl)-1H-pyrazol-3-yl]-N-methylaniline;sulfur dioxide
CID 159364916
N-[2-[5-(furan-2-yl)-1H-pyrazol-3-yl]phenyl]-4-methylbenzamide
CID 122425162
N-[4-(2-carbamoylphenoxy)but-2-ynyl]-5-(furan-2-yl)-1H-pyrazole-3-carboxamide
CID 71803213
(2-fluorophenyl)-[4-[5-(furan-2-yl)-1H-pyrazole-3-carbonyl]piperazin-1-yl]methanone
CID 20910914
5-amino-3-(furan-2-yl)-1H-pyridazin-6-one
CID 51589117
2-[2-(1H-pyrazol-5-yl)phenyl]benzamide
CID 69317504
2-amino-3-(furan-2-yl)benzoic acid
CID 10798178
5-(furan-2-yl)-N-[2-(propan-2-ylcarbamoyl)phenyl]-1H-pyrazole-3-carboxamide
CID 34564904
2-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-pyridinyl]benzamide
CID 175776951
N-tert-butyl-5-(furan-2-yl)-1H-pyrazole-3-carboxamide
CID 6626158
5-(furan-2-yl)-3-(3-methoxyphenyl)-1H-pyrazole
CID 73052635
N-(3-aminobutyl)-5-(furan-2-yl)-1H-pyrazole-3-carboxamide
CID 119498062

Frequently Asked Questions

What is the IUPAC name of 2-[5-(furan-2-yl)-1H-pyrazol-3-yl]benzamide?
The IUPAC name of 2-[5-(furan-2-yl)-1H-pyrazol-3-yl]benzamide (CID 130376801) is 2-[5-(furan-2-yl)-1H-pyrazol-3-yl]benzamide.
What is the SMILES notation for 2-[5-(furan-2-yl)-1H-pyrazol-3-yl]benzamide?
The canonical SMILES for 2-[5-(furan-2-yl)-1H-pyrazol-3-yl]benzamide is NC(=O)c1ccccc1-c1cc(-c2ccco2)[nH]n1.
What is the InChIKey of 2-[5-(furan-2-yl)-1H-pyrazol-3-yl]benzamide?
The InChIKey is IZWXWAJFWXNSSE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11N3O2/c15-14(18)10-5-2-1-4-9(10)11-8-12(17-16-11)13-6-3-7-19-13/h1-8H,(H2,15,18)(H,16,17).
What are the key properties of 2-[5-(furan-2-yl)-1H-pyrazol-3-yl]benzamide?
2-[5-(furan-2-yl)-1H-pyrazol-3-yl]benzamide has a molecular weight of 253.26 g/mol, XLogP of 2.44, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[5-(furan-2-yl)-1H-pyrazol-3-yl]benzamide is sourced from PubChem (CID 130376801), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).