7,8-dihydro-5H-1,6-naphthyridin-6-yl(1H-indazol-5-yl)methanone

C16H14N4O — CID 166197233

IUPAC7,8-dihydro-5H-1,6-naphthyridin-6-yl(1H-indazol-5-yl)methanone
SMILESO=C(c1ccc2[nH]ncc2c1)N1CCc2ncccc2C1
InChIInChI=1S/C16H14N4O/c21-16(11-3-4-15-13(8-11)9-18-19-15)20-7-5-14-12(10-20)2-1-6-17-14/h1-4,6,8-9H,5,7,10H2,(H,18,19)
InChIKeyPJEWECMAUZUJLU-UHFFFAOYSA-N
MW278.31 g/mol
LogP2.16
Rot. Bonds1

About 7,8-dihydro-5H-1,6-naphthyridin-6-yl(1H-indazol-5-yl)methanone

7,8-dihydro-5H-1,6-naphthyridin-6-yl(1H-indazol-5-yl)methanone (PubChem CID 166197233) has the molecular formula C16H14N4O and a molecular weight of 278.31 g/mol. Its IUPAC name is 7,8-dihydro-5H-1,6-naphthyridin-6-yl(1H-indazol-5-yl)methanone.

Molecular Properties

Compound Name7,8-dihydro-5H-1,6-naphthyridin-6-yl(1H-indazol-5-yl)methanone
PubChem CID166197233
Molecular FormulaC16H14N4O
Molecular Weight278.31 g/mol
Exact Mass278.12
IUPAC Name7,8-dihydro-5H-1,6-naphthyridin-6-yl(1H-indazol-5-yl)methanone
SMILESO=C(c1ccc2[nH]ncc2c1)N1CCc2ncccc2C1
InChIInChI=1S/C16H14N4O/c21-16(11-3-4-15-13(8-11)9-18-19-15)20-7-5-14-12(10-20)2-1-6-17-14/h1-4,6,8-9H,5,7,10H2,(H,18,19)
InChIKeyPJEWECMAUZUJLU-UHFFFAOYSA-N
XLogP2.16
TPSA61.88 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.31
LogP ≤ 52.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 7,8-dihydro-5H-1,6-naphthyridin-6-yl(1H-indazol-5-yl)methanone?
The IUPAC name of 7,8-dihydro-5H-1,6-naphthyridin-6-yl(1H-indazol-5-yl)methanone (CID 166197233) is 7,8-dihydro-5H-1,6-naphthyridin-6-yl(1H-indazol-5-yl)methanone.
What is the SMILES notation for 7,8-dihydro-5H-1,6-naphthyridin-6-yl(1H-indazol-5-yl)methanone?
The canonical SMILES for 7,8-dihydro-5H-1,6-naphthyridin-6-yl(1H-indazol-5-yl)methanone is O=C(c1ccc2[nH]ncc2c1)N1CCc2ncccc2C1.
What is the InChIKey of 7,8-dihydro-5H-1,6-naphthyridin-6-yl(1H-indazol-5-yl)methanone?
The InChIKey is PJEWECMAUZUJLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14N4O/c21-16(11-3-4-15-13(8-11)9-18-19-15)20-7-5-14-12(10-20)2-1-6-17-14/h1-4,6,8-9H,5,7,10H2,(H,18,19).
What are the key properties of 7,8-dihydro-5H-1,6-naphthyridin-6-yl(1H-indazol-5-yl)methanone?
7,8-dihydro-5H-1,6-naphthyridin-6-yl(1H-indazol-5-yl)methanone has a molecular weight of 278.31 g/mol, XLogP of 2.16, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7,8-dihydro-5H-1,6-naphthyridin-6-yl(1H-indazol-5-yl)methanone is sourced from PubChem (CID 166197233), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).