5-(1-methylpyrazol-4-yl)-3-(2-phenylphenyl)furo[3,2-b]pyridine

C23H17N3O — CID 118493250

IUPAC5-(1-methylpyrazol-4-yl)-3-(2-phenylphenyl)furo[3,2-b]pyridine
SMILESCn1cc(-c2ccc3occ(-c4ccccc4-c4ccccc4)c3n2)cn1
InChIInChI=1S/C23H17N3O/c1-26-14-17(13-24-26)21-11-12-22-23(25-21)20(15-27-22)19-10-6-5-9-18(19)16-7-3-2-4-8-16/h2-15H,1H3
InChIKeyQSBNKGGRYOLZND-UHFFFAOYSA-N
MW351.41 g/mol
LogP5.56
Rot. Bonds3

About 5-(1-methylpyrazol-4-yl)-3-(2-phenylphenyl)furo[3,2-b]pyridine

5-(1-methylpyrazol-4-yl)-3-(2-phenylphenyl)furo[3,2-b]pyridine (PubChem CID 118493250) has the molecular formula C23H17N3O and a molecular weight of 351.41 g/mol. Its IUPAC name is 5-(1-methylpyrazol-4-yl)-3-(2-phenylphenyl)furo[3,2-b]pyridine.

Molecular Properties

Compound Name5-(1-methylpyrazol-4-yl)-3-(2-phenylphenyl)furo[3,2-b]pyridine
PubChem CID118493250
Molecular FormulaC23H17N3O
Molecular Weight351.41 g/mol
Exact Mass351.14
IUPAC Name5-(1-methylpyrazol-4-yl)-3-(2-phenylphenyl)furo[3,2-b]pyridine
SMILESCn1cc(-c2ccc3occ(-c4ccccc4-c4ccccc4)c3n2)cn1
InChIInChI=1S/C23H17N3O/c1-26-14-17(13-24-26)21-11-12-22-23(25-21)20(15-27-22)19-10-6-5-9-18(19)16-7-3-2-4-8-16/h2-15H,1H3
InChIKeyQSBNKGGRYOLZND-UHFFFAOYSA-N
XLogP5.56
TPSA43.85 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500351.41
LogP ≤ 55.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

(2s)-1-{[6-Furan-3-Yl-5-(3-Methyl-2h-Indazol-5-Yl)pyridin-3-Yl]oxy}-3-(1h-Indol-3-Yl)propan-2-Amine
CID 46225540
5-(1-Methyl-1H-pyrazol-4-yl)-3-(3-(pyridin-4-yl)phenyl)furo[3,2-b]pyridine
CID 155891794
4-[3-(4-Fluorophenyl)furo[3,2-b]pyridin-2-yl]pyridine
CID 10935149
3-(4-Tert-butylphenyl)-5-(1H-pyrazol-4-yl)furo[3,2-b]pyridine
CID 118493227
6-[4-[4-(2-Methoxyphenyl)piperazin-1-yl]butoxy]pyrazolo[1,5-a]pyridine-3-carbaldehyde
CID 25072941
(2S)-1-(1H-indol-3-yl)-3-(5-(3-methyl-1H-indazol-5-yl)-6-(2-methylfuran-3-yl)pyridin-3-yloxy)propan-2-amine
CID 46190874
3-[(2S,4S)-2-ethyloxan-4-yl]-6,12-bis(1-methylpyrazol-4-yl)-8-oxa-3,5,13-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5,10,12-pentaen-4-one
CID 71681904
Npb-22
CID 118796435
N-{4-[(6-methoxypyrazolo[1,5-a]pyridine-3-carbonyl)amino]-3-methylphenyl}-1-methyl-1H-indazole-3-carboxamide
CID 139209093
6-[4-[[(2S)-5-hydroxy-1,2,3,4-tetrahydronaphthalen-2-yl]-propylamino]butoxy]pyrazolo[1,5-a]pyridine-3-carbaldehyde
CID 137640371
(S)-1-(6-(furan-3-yl)-5-(3-methyl-1H-indazol-5-yl)pyridin-3-yloxy)-3-phenylpropan-2-amine
CID 11495551
5-[4-[4-(2-Methoxyphenyl)piperazin-1-yl]butoxy]pyrazolo[1,5-a]pyridine-3-carbaldehyde
CID 25071385

Frequently Asked Questions

What is the IUPAC name of 5-(1-methylpyrazol-4-yl)-3-(2-phenylphenyl)furo[3,2-b]pyridine?
The IUPAC name of 5-(1-methylpyrazol-4-yl)-3-(2-phenylphenyl)furo[3,2-b]pyridine (CID 118493250) is 5-(1-methylpyrazol-4-yl)-3-(2-phenylphenyl)furo[3,2-b]pyridine.
What is the SMILES notation for 5-(1-methylpyrazol-4-yl)-3-(2-phenylphenyl)furo[3,2-b]pyridine?
The canonical SMILES for 5-(1-methylpyrazol-4-yl)-3-(2-phenylphenyl)furo[3,2-b]pyridine is Cn1cc(-c2ccc3occ(-c4ccccc4-c4ccccc4)c3n2)cn1.
What is the InChIKey of 5-(1-methylpyrazol-4-yl)-3-(2-phenylphenyl)furo[3,2-b]pyridine?
The InChIKey is QSBNKGGRYOLZND-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H17N3O/c1-26-14-17(13-24-26)21-11-12-22-23(25-21)20(15-27-22)19-10-6-5-9-18(19)16-7-3-2-4-8-16/h2-15H,1H3.
What are the key properties of 5-(1-methylpyrazol-4-yl)-3-(2-phenylphenyl)furo[3,2-b]pyridine?
5-(1-methylpyrazol-4-yl)-3-(2-phenylphenyl)furo[3,2-b]pyridine has a molecular weight of 351.41 g/mol, XLogP of 5.56, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(1-methylpyrazol-4-yl)-3-(2-phenylphenyl)furo[3,2-b]pyridine is sourced from PubChem (CID 118493250), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).