1H-pyrazolo[4,5-h]isoquinoline

C10H7N3 — CID 70533280

IUPAC1H-pyrazolo[4,5-h]isoquinoline
SMILESc1cc2ccc3cn[nH]c3c2cn1
InChIInChI=1S/C10H7N3/c1-2-8-5-12-13-10(8)9-6-11-4-3-7(1)9/h1-6H,(H,12,13)
InChIKeyPWFBLQFJGFAIQK-UHFFFAOYSA-N
MW169.19 g/mol
LogP2.11
Rot. Bonds

About 1H-pyrazolo[4,5-h]isoquinoline

1H-pyrazolo[4,5-h]isoquinoline (PubChem CID 70533280) has the molecular formula C10H7N3 and a molecular weight of 169.19 g/mol. Its IUPAC name is 1H-pyrazolo[4,5-h]isoquinoline.

Molecular Properties

Compound Name1H-pyrazolo[4,5-h]isoquinoline
PubChem CID70533280
Molecular FormulaC10H7N3
Molecular Weight169.19 g/mol
Exact Mass169.06
IUPAC Name1H-pyrazolo[4,5-h]isoquinoline
SMILESc1cc2ccc3cn[nH]c3c2cn1
InChIInChI=1S/C10H7N3/c1-2-8-5-12-13-10(8)9-6-11-4-3-7(1)9/h1-6H,(H,12,13)
InChIKeyPWFBLQFJGFAIQK-UHFFFAOYSA-N
XLogP2.11
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.19
LogP ≤ 52.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1H-pyrazolo[4,5-h]isoquinoline?
The IUPAC name of 1H-pyrazolo[4,5-h]isoquinoline (CID 70533280) is 1H-pyrazolo[4,5-h]isoquinoline.
What is the SMILES notation for 1H-pyrazolo[4,5-h]isoquinoline?
The canonical SMILES for 1H-pyrazolo[4,5-h]isoquinoline is c1cc2ccc3cn[nH]c3c2cn1.
What is the InChIKey of 1H-pyrazolo[4,5-h]isoquinoline?
The InChIKey is PWFBLQFJGFAIQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H7N3/c1-2-8-5-12-13-10(8)9-6-11-4-3-7(1)9/h1-6H,(H,12,13).
What are the key properties of 1H-pyrazolo[4,5-h]isoquinoline?
1H-pyrazolo[4,5-h]isoquinoline has a molecular weight of 169.19 g/mol, XLogP of 2.11, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1H-pyrazolo[4,5-h]isoquinoline is sourced from PubChem (CID 70533280), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).