3,5-bis(1-methylpyrazol-4-yl)-1H-pyrazolo[3,4-c]pyridine

C14H13N7 — CID 71253902

IUPAC3,5-bis(1-methylpyrazol-4-yl)-1H-pyrazolo[3,4-c]pyridine
SMILESCn1cc(-c2cc3c(-c4cnn(C)c4)n[nH]c3cn2)cn1
InChIInChI=1S/C14H13N7/c1-20-7-9(4-16-20)12-3-11-13(6-15-12)18-19-14(11)10-5-17-21(2)8-10/h3-8H,1-2H3,(H,18,19)
InChIKeyKOJVSNLWDOEHCI-UHFFFAOYSA-N
MW279.31 g/mol
LogP1.76
Rot. Bonds2

About 3,5-bis(1-methylpyrazol-4-yl)-1H-pyrazolo[3,4-c]pyridine

3,5-bis(1-methylpyrazol-4-yl)-1H-pyrazolo[3,4-c]pyridine (PubChem CID 71253902) has the molecular formula C14H13N7 and a molecular weight of 279.31 g/mol. Its IUPAC name is 3,5-bis(1-methylpyrazol-4-yl)-1H-pyrazolo[3,4-c]pyridine.

Molecular Properties

Compound Name3,5-bis(1-methylpyrazol-4-yl)-1H-pyrazolo[3,4-c]pyridine
PubChem CID71253902
Molecular FormulaC14H13N7
Molecular Weight279.31 g/mol
Exact Mass279.12
IUPAC Name3,5-bis(1-methylpyrazol-4-yl)-1H-pyrazolo[3,4-c]pyridine
SMILESCn1cc(-c2cc3c(-c4cnn(C)c4)n[nH]c3cn2)cn1
InChIInChI=1S/C14H13N7/c1-20-7-9(4-16-20)12-3-11-13(6-15-12)18-19-14(11)10-5-17-21(2)8-10/h3-8H,1-2H3,(H,18,19)
InChIKeyKOJVSNLWDOEHCI-UHFFFAOYSA-N
XLogP1.76
TPSA77.21 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.31
LogP ≤ 51.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 3,5-bis(1-methylpyrazol-4-yl)-1H-pyrazolo[3,4-c]pyridine?
The IUPAC name of 3,5-bis(1-methylpyrazol-4-yl)-1H-pyrazolo[3,4-c]pyridine (CID 71253902) is 3,5-bis(1-methylpyrazol-4-yl)-1H-pyrazolo[3,4-c]pyridine.
What is the SMILES notation for 3,5-bis(1-methylpyrazol-4-yl)-1H-pyrazolo[3,4-c]pyridine?
The canonical SMILES for 3,5-bis(1-methylpyrazol-4-yl)-1H-pyrazolo[3,4-c]pyridine is Cn1cc(-c2cc3c(-c4cnn(C)c4)n[nH]c3cn2)cn1.
What is the InChIKey of 3,5-bis(1-methylpyrazol-4-yl)-1H-pyrazolo[3,4-c]pyridine?
The InChIKey is KOJVSNLWDOEHCI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13N7/c1-20-7-9(4-16-20)12-3-11-13(6-15-12)18-19-14(11)10-5-17-21(2)8-10/h3-8H,1-2H3,(H,18,19).
What are the key properties of 3,5-bis(1-methylpyrazol-4-yl)-1H-pyrazolo[3,4-c]pyridine?
3,5-bis(1-methylpyrazol-4-yl)-1H-pyrazolo[3,4-c]pyridine has a molecular weight of 279.31 g/mol, XLogP of 1.76, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-bis(1-methylpyrazol-4-yl)-1H-pyrazolo[3,4-c]pyridine is sourced from PubChem (CID 71253902), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).