5-(5-phenylmethoxyfuran-2-yl)-1H-pyrazole

C14H12N2O2 — CID 57277237

IUPAC5-(5-phenylmethoxyfuran-2-yl)-1H-pyrazole
SMILESc1ccc(COc2ccc(-c3ccn[nH]3)o2)cc1
InChIInChI=1S/C14H12N2O2/c1-2-4-11(5-3-1)10-17-14-7-6-13(18-14)12-8-9-15-16-12/h1-9H,10H2,(H,15,16)
InChIKeyWWXKFSZHENKVAU-UHFFFAOYSA-N
MW240.26 g/mol
LogP3.25
Rot. Bonds4

About 5-(5-phenylmethoxyfuran-2-yl)-1H-pyrazole

5-(5-phenylmethoxyfuran-2-yl)-1H-pyrazole (PubChem CID 57277237) has the molecular formula C14H12N2O2 and a molecular weight of 240.26 g/mol. Its IUPAC name is 5-(5-phenylmethoxyfuran-2-yl)-1H-pyrazole.

Molecular Properties

Compound Name5-(5-phenylmethoxyfuran-2-yl)-1H-pyrazole
PubChem CID57277237
Molecular FormulaC14H12N2O2
Molecular Weight240.26 g/mol
Exact Mass240.09
IUPAC Name5-(5-phenylmethoxyfuran-2-yl)-1H-pyrazole
SMILESc1ccc(COc2ccc(-c3ccn[nH]3)o2)cc1
InChIInChI=1S/C14H12N2O2/c1-2-4-11(5-3-1)10-17-14-7-6-13(18-14)12-8-9-15-16-12/h1-9H,10H2,(H,15,16)
InChIKeyWWXKFSZHENKVAU-UHFFFAOYSA-N
XLogP3.25
TPSA51.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.26
LogP ≤ 53.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-(5-methoxy-2-phenylmethoxyphenyl)-1H-pyrazole
CID 57432903
4-[[4-phenyl-5-[5-(1H-pyrazol-5-yl)furan-2-yl]imidazol-1-yl]methyl]pyridine
CID 50974400
benzyl 3-(1H-pyrazol-5-yl)cyclohex-2-ene-1-carboxylate
CID 156779855
4-(1H-pyrazol-5-yloxymethyl)pyridine
CID 164914774
2-hydroxy-N-[(5-phenylmethoxyfuran-2-yl)methyl]acetamide
CID 166504152
3,6-bis(phenylmethoxy)pyridazine
CID 68982842
4,7-bis(phenylmethoxy)-1,10-phenanthroline
CID 23134911
2-(phenylmethoxymethyl)-5-[5-(phenylmethoxymethyl)furan-2-yl]furan
CID 102127806
4-(5-phenylmethoxy-1H-pyrazol-4-yl)pyridine
CID 67461933
3-phenylmethoxy-1H-azet-2-one
CID 174589199
5-naphthalen-1-yl-1H-pyrazole
CID 2737035
1-phenyl-N-[[3-(1H-pyrazol-5-yl)phenyl]methyl]methanamine
CID 10539500

Frequently Asked Questions

What is the IUPAC name of 5-(5-phenylmethoxyfuran-2-yl)-1H-pyrazole?
The IUPAC name of 5-(5-phenylmethoxyfuran-2-yl)-1H-pyrazole (CID 57277237) is 5-(5-phenylmethoxyfuran-2-yl)-1H-pyrazole.
What is the SMILES notation for 5-(5-phenylmethoxyfuran-2-yl)-1H-pyrazole?
The canonical SMILES for 5-(5-phenylmethoxyfuran-2-yl)-1H-pyrazole is c1ccc(COc2ccc(-c3ccn[nH]3)o2)cc1.
What is the InChIKey of 5-(5-phenylmethoxyfuran-2-yl)-1H-pyrazole?
The InChIKey is WWXKFSZHENKVAU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12N2O2/c1-2-4-11(5-3-1)10-17-14-7-6-13(18-14)12-8-9-15-16-12/h1-9H,10H2,(H,15,16).
What are the key properties of 5-(5-phenylmethoxyfuran-2-yl)-1H-pyrazole?
5-(5-phenylmethoxyfuran-2-yl)-1H-pyrazole has a molecular weight of 240.26 g/mol, XLogP of 3.25, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(5-phenylmethoxyfuran-2-yl)-1H-pyrazole is sourced from PubChem (CID 57277237), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).