1,5-dihydropyrazolo[4,5-c][1,5]naphthyridin-4-one

C9H6N4O — CID 136995246

IUPAC1,5-dihydropyrazolo[4,5-c][1,5]naphthyridin-4-one
SMILESO=c1[nH]c2cccnc2c2[nH]ncc12
InChIInChI=1S/C9H6N4O/c14-9-5-4-11-13-7(5)8-6(12-9)2-1-3-10-8/h1-4H,(H,11,13)(H,12,14)
InChIKeyBHXMJDUETSCSLU-UHFFFAOYSA-N
MW186.17 g/mol
LogP0.80
Rot. Bonds

About 1,5-dihydropyrazolo[4,5-c][1,5]naphthyridin-4-one

1,5-dihydropyrazolo[4,5-c][1,5]naphthyridin-4-one (PubChem CID 136995246) has the molecular formula C9H6N4O and a molecular weight of 186.17 g/mol. Its IUPAC name is 1,5-dihydropyrazolo[4,5-c][1,5]naphthyridin-4-one.

Molecular Properties

Compound Name1,5-dihydropyrazolo[4,5-c][1,5]naphthyridin-4-one
PubChem CID136995246
Molecular FormulaC9H6N4O
Molecular Weight186.17 g/mol
Exact Mass186.05
IUPAC Name1,5-dihydropyrazolo[4,5-c][1,5]naphthyridin-4-one
SMILESO=c1[nH]c2cccnc2c2[nH]ncc12
InChIInChI=1S/C9H6N4O/c14-9-5-4-11-13-7(5)8-6(12-9)2-1-3-10-8/h1-4H,(H,11,13)(H,12,14)
InChIKeyBHXMJDUETSCSLU-UHFFFAOYSA-N
XLogP0.80
TPSA74.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.17
LogP ≤ 50.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1,5-dihydropyrazolo[4,5-c][1,5]naphthyridin-4-one?
The IUPAC name of 1,5-dihydropyrazolo[4,5-c][1,5]naphthyridin-4-one (CID 136995246) is 1,5-dihydropyrazolo[4,5-c][1,5]naphthyridin-4-one.
What is the SMILES notation for 1,5-dihydropyrazolo[4,5-c][1,5]naphthyridin-4-one?
The canonical SMILES for 1,5-dihydropyrazolo[4,5-c][1,5]naphthyridin-4-one is O=c1[nH]c2cccnc2c2[nH]ncc12.
What is the InChIKey of 1,5-dihydropyrazolo[4,5-c][1,5]naphthyridin-4-one?
The InChIKey is BHXMJDUETSCSLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H6N4O/c14-9-5-4-11-13-7(5)8-6(12-9)2-1-3-10-8/h1-4H,(H,11,13)(H,12,14).
What are the key properties of 1,5-dihydropyrazolo[4,5-c][1,5]naphthyridin-4-one?
1,5-dihydropyrazolo[4,5-c][1,5]naphthyridin-4-one has a molecular weight of 186.17 g/mol, XLogP of 0.80, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1,5-dihydropyrazolo[4,5-c][1,5]naphthyridin-4-one is sourced from PubChem (CID 136995246), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).