6-[5-(3-methoxyphenyl)pyrazol-1-yl]-1H-indazole

C17H14N4O — CID 70981884

IUPAC6-[5-(3-methoxyphenyl)pyrazol-1-yl]-1H-indazole
SMILESCOc1cccc(-c2ccnn2-c2ccc3cn[nH]c3c2)c1
InChIInChI=1S/C17H14N4O/c1-22-15-4-2-3-12(9-15)17-7-8-19-21(17)14-6-5-13-11-18-20-16(13)10-14/h2-11H,1H3,(H,18,20)
InChIKeySHYUVNXVVXFPPK-UHFFFAOYSA-N
MW290.33 g/mol
LogP3.42
Rot. Bonds3

About 6-[5-(3-methoxyphenyl)pyrazol-1-yl]-1H-indazole

6-[5-(3-methoxyphenyl)pyrazol-1-yl]-1H-indazole (PubChem CID 70981884) has the molecular formula C17H14N4O and a molecular weight of 290.33 g/mol. Its IUPAC name is 6-[5-(3-methoxyphenyl)pyrazol-1-yl]-1H-indazole.

Molecular Properties

Compound Name6-[5-(3-methoxyphenyl)pyrazol-1-yl]-1H-indazole
PubChem CID70981884
Molecular FormulaC17H14N4O
Molecular Weight290.33 g/mol
Exact Mass290.12
IUPAC Name6-[5-(3-methoxyphenyl)pyrazol-1-yl]-1H-indazole
SMILESCOc1cccc(-c2ccnn2-c2ccc3cn[nH]c3c2)c1
InChIInChI=1S/C17H14N4O/c1-22-15-4-2-3-12(9-15)17-7-8-19-21(17)14-6-5-13-11-18-20-16(13)10-14/h2-11H,1H3,(H,18,20)
InChIKeySHYUVNXVVXFPPK-UHFFFAOYSA-N
XLogP3.42
TPSA55.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.33
LogP ≤ 53.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-(3-methoxyphenyl)-1-phenylpyrazole
CID 44632701
1-(4-methoxyphenyl)-5-[3-(4-methoxyphenyl)phenyl]pyrazole
CID 90030830
5-(3-methoxyphenyl)-1-[4-(pyrrolidin-1-ylmethyl)phenyl]pyrazole
CID 70981613
ethane;6-methoxy-1H-indazole
CID 144719676
1,5-bis(4-methoxyphenyl)pyrazole
CID 57058186
5-fluoro-1-(1H-indazol-6-yl)-6-[2-(3-methylphenyl)pyrazol-3-yl]benzotriazole
CID 146433351
5-(3,4-dichlorophenyl)-1-(4-methoxyphenyl)pyrazole
CID 22171007
methyl 2-[5-(1H-indazol-6-yl)pyrazol-1-yl]pyridine-4-carboxylate
CID 90205112
5-methoxy-2-[2-(3-methoxyphenyl)pyrazol-3-yl]phenol
CID 135520262
5-bromo-1-(3-methoxyphenyl)pyrazole
CID 112693887
1-ethyl-4-[4-[5-[3-(fluoromethoxy)phenyl]pyrazol-1-yl]phenyl]piperazine
CID 153409903
5-[2-(4-fluorophenyl)pyrazol-3-yl]-3-(4-methoxyphenyl)-2,1-benzoxazole
CID 73053002

Frequently Asked Questions

What is the IUPAC name of 6-[5-(3-methoxyphenyl)pyrazol-1-yl]-1H-indazole?
The IUPAC name of 6-[5-(3-methoxyphenyl)pyrazol-1-yl]-1H-indazole (CID 70981884) is 6-[5-(3-methoxyphenyl)pyrazol-1-yl]-1H-indazole.
What is the SMILES notation for 6-[5-(3-methoxyphenyl)pyrazol-1-yl]-1H-indazole?
The canonical SMILES for 6-[5-(3-methoxyphenyl)pyrazol-1-yl]-1H-indazole is COc1cccc(-c2ccnn2-c2ccc3cn[nH]c3c2)c1.
What is the InChIKey of 6-[5-(3-methoxyphenyl)pyrazol-1-yl]-1H-indazole?
The InChIKey is SHYUVNXVVXFPPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14N4O/c1-22-15-4-2-3-12(9-15)17-7-8-19-21(17)14-6-5-13-11-18-20-16(13)10-14/h2-11H,1H3,(H,18,20).
What are the key properties of 6-[5-(3-methoxyphenyl)pyrazol-1-yl]-1H-indazole?
6-[5-(3-methoxyphenyl)pyrazol-1-yl]-1H-indazole has a molecular weight of 290.33 g/mol, XLogP of 3.42, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[5-(3-methoxyphenyl)pyrazol-1-yl]-1H-indazole is sourced from PubChem (CID 70981884), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).