6-(1-methyl-3-pyridin-4-ylpyrazol-4-yl)-1,4-dihydroindeno[2,1-d]pyrazole

C19H15N5 — CID 25093326

IUPAC6-(1-methyl-3-pyridin-4-ylpyrazol-4-yl)-1,4-dihydroindeno[2,1-d]pyrazole
SMILESCn1cc(-c2ccc3c(c2)Cc2cn[nH]c2-3)c(-c2ccncc2)n1
InChIInChI=1S/C19H15N5/c1-24-11-17(19(23-24)12-4-6-20-7-5-12)13-2-3-16-14(8-13)9-15-10-21-22-18(15)16/h2-8,10-11H,9H2,1H3,(H,21,22)
InChIKeyMAOYHJWWEYWDEQ-UHFFFAOYSA-N
MW313.36 g/mol
LogP3.44
Rot. Bonds2

About 6-(1-methyl-3-pyridin-4-ylpyrazol-4-yl)-1,4-dihydroindeno[2,1-d]pyrazole

6-(1-methyl-3-pyridin-4-ylpyrazol-4-yl)-1,4-dihydroindeno[2,1-d]pyrazole (PubChem CID 25093326) has the molecular formula C19H15N5 and a molecular weight of 313.36 g/mol. Its IUPAC name is 6-(1-methyl-3-pyridin-4-ylpyrazol-4-yl)-1,4-dihydroindeno[2,1-d]pyrazole.

Molecular Properties

Compound Name6-(1-methyl-3-pyridin-4-ylpyrazol-4-yl)-1,4-dihydroindeno[2,1-d]pyrazole
PubChem CID25093326
Molecular FormulaC19H15N5
Molecular Weight313.36 g/mol
Exact Mass313.13
IUPAC Name6-(1-methyl-3-pyridin-4-ylpyrazol-4-yl)-1,4-dihydroindeno[2,1-d]pyrazole
SMILESCn1cc(-c2ccc3c(c2)Cc2cn[nH]c2-3)c(-c2ccncc2)n1
InChIInChI=1S/C19H15N5/c1-24-11-17(19(23-24)12-4-6-20-7-5-12)13-2-3-16-14(8-13)9-15-10-21-22-18(15)16/h2-8,10-11H,9H2,1H3,(H,21,22)
InChIKeyMAOYHJWWEYWDEQ-UHFFFAOYSA-N
XLogP3.44
TPSA59.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.36
LogP ≤ 53.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-(1-methyl-3-pyridin-4-ylpyrazol-4-yl)-1,4-dihydroindeno[2,1-d]pyrazole?
The IUPAC name of 6-(1-methyl-3-pyridin-4-ylpyrazol-4-yl)-1,4-dihydroindeno[2,1-d]pyrazole (CID 25093326) is 6-(1-methyl-3-pyridin-4-ylpyrazol-4-yl)-1,4-dihydroindeno[2,1-d]pyrazole.
What is the SMILES notation for 6-(1-methyl-3-pyridin-4-ylpyrazol-4-yl)-1,4-dihydroindeno[2,1-d]pyrazole?
The canonical SMILES for 6-(1-methyl-3-pyridin-4-ylpyrazol-4-yl)-1,4-dihydroindeno[2,1-d]pyrazole is Cn1cc(-c2ccc3c(c2)Cc2cn[nH]c2-3)c(-c2ccncc2)n1.
What is the InChIKey of 6-(1-methyl-3-pyridin-4-ylpyrazol-4-yl)-1,4-dihydroindeno[2,1-d]pyrazole?
The InChIKey is MAOYHJWWEYWDEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15N5/c1-24-11-17(19(23-24)12-4-6-20-7-5-12)13-2-3-16-14(8-13)9-15-10-21-22-18(15)16/h2-8,10-11H,9H2,1H3,(H,21,22).
What are the key properties of 6-(1-methyl-3-pyridin-4-ylpyrazol-4-yl)-1,4-dihydroindeno[2,1-d]pyrazole?
6-(1-methyl-3-pyridin-4-ylpyrazol-4-yl)-1,4-dihydroindeno[2,1-d]pyrazole has a molecular weight of 313.36 g/mol, XLogP of 3.44, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(1-methyl-3-pyridin-4-ylpyrazol-4-yl)-1,4-dihydroindeno[2,1-d]pyrazole is sourced from PubChem (CID 25093326), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).