5-(furan-2-yl)-3-(3-methoxyphenyl)-1H-pyrazole

C14H12N2O2 — CID 73052635

IUPAC5-(furan-2-yl)-3-(3-methoxyphenyl)-1H-pyrazole
SMILESCOc1cccc(-c2cc(-c3ccco3)[nH]n2)c1
InChIInChI=1S/C14H12N2O2/c1-17-11-5-2-4-10(8-11)12-9-13(16-15-12)14-6-3-7-18-14/h2-9H,1H3,(H,15,16)
InChIKeyLJPCAMIIMGUDQR-UHFFFAOYSA-N
MW240.26 g/mol
LogP3.35
Rot. Bonds3

About 5-(furan-2-yl)-3-(3-methoxyphenyl)-1H-pyrazole

5-(furan-2-yl)-3-(3-methoxyphenyl)-1H-pyrazole (PubChem CID 73052635) has the molecular formula C14H12N2O2 and a molecular weight of 240.26 g/mol. Its IUPAC name is 5-(furan-2-yl)-3-(3-methoxyphenyl)-1H-pyrazole.

Molecular Properties

Compound Name5-(furan-2-yl)-3-(3-methoxyphenyl)-1H-pyrazole
PubChem CID73052635
Molecular FormulaC14H12N2O2
Molecular Weight240.26 g/mol
Exact Mass240.09
IUPAC Name5-(furan-2-yl)-3-(3-methoxyphenyl)-1H-pyrazole
SMILESCOc1cccc(-c2cc(-c3ccco3)[nH]n2)c1
InChIInChI=1S/C14H12N2O2/c1-17-11-5-2-4-10(8-11)12-9-13(16-15-12)14-6-3-7-18-14/h2-9H,1H3,(H,15,16)
InChIKeyLJPCAMIIMGUDQR-UHFFFAOYSA-N
XLogP3.35
TPSA51.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.26
LogP ≤ 53.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-(furan-2-yl)-N-(3-methoxyphenyl)-1H-pyrazole-3-carboxamide
CID 19513850
5-(1,1-difluoroethyl)-3-(3-methoxyphenyl)-1H-pyrazole
CID 142088621
(1S)-1-[3-(3-methoxyphenyl)-1H-pyrazol-5-yl]ethanamine
CID 82393432
6-chloro-3-[3-(3-methoxyphenyl)-1H-pyrazol-5-yl]-1H-indazole
CID 71694716
[4-(furan-2-ylmethyl)piperazin-1-yl]-[3-(3-methoxyphenyl)-1H-pyrazol-5-yl]methanone
CID 19515033
2-[4-(3-methoxyphenoxy)phenyl]furan
CID 168524914
5-(bromomethyl)-3-(3-methoxyphenyl)-1H-pyridazin-6-one
CID 82445918
5-(furan-2-yl)-N-[2-hydroxy-2-(3-methoxyphenyl)ethyl]-1H-pyrazole-3-carboxamide
CID 111115498
azane;1-methoxy-3-(3-methoxyphenyl)benzene
CID 174719266
1-methoxy-3-(3-methoxyphenyl)benzene;sulfane
CID 175169762
3-(2,4-dichlorophenyl)-5-[3-(3-methoxyphenyl)-1H-pyrazol-5-yl]-1,2,4-oxadiazole
CID 19330341
3-(3-methoxyphenyl)-N-methyl-1,2-oxazol-5-amine
CID 134400305

Frequently Asked Questions

What is the IUPAC name of 5-(furan-2-yl)-3-(3-methoxyphenyl)-1H-pyrazole?
The IUPAC name of 5-(furan-2-yl)-3-(3-methoxyphenyl)-1H-pyrazole (CID 73052635) is 5-(furan-2-yl)-3-(3-methoxyphenyl)-1H-pyrazole.
What is the SMILES notation for 5-(furan-2-yl)-3-(3-methoxyphenyl)-1H-pyrazole?
The canonical SMILES for 5-(furan-2-yl)-3-(3-methoxyphenyl)-1H-pyrazole is COc1cccc(-c2cc(-c3ccco3)[nH]n2)c1.
What is the InChIKey of 5-(furan-2-yl)-3-(3-methoxyphenyl)-1H-pyrazole?
The InChIKey is LJPCAMIIMGUDQR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12N2O2/c1-17-11-5-2-4-10(8-11)12-9-13(16-15-12)14-6-3-7-18-14/h2-9H,1H3,(H,15,16).
What are the key properties of 5-(furan-2-yl)-3-(3-methoxyphenyl)-1H-pyrazole?
5-(furan-2-yl)-3-(3-methoxyphenyl)-1H-pyrazole has a molecular weight of 240.26 g/mol, XLogP of 3.35, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(furan-2-yl)-3-(3-methoxyphenyl)-1H-pyrazole is sourced from PubChem (CID 73052635), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).