5-[6-(1,7-diazaspiro[3.5]nonan-1-yl)-1,5-naphthyridin-2-yl]-2-methylindazol-6-ol

C23H24N6O — CID 162433370

IUPAC5-[6-(1,7-diazaspiro[3.5]nonan-1-yl)-1,5-naphthyridin-2-yl]-2-methylindazol-6-ol
SMILESCn1cc2cc(-c3ccc4nc(N5CCC56CCNCC6)ccc4n3)c(O)cc2n1
InChIInChI=1S/C23H24N6O/c1-28-14-15-12-16(21(30)13-20(15)27-28)17-2-3-19-18(25-17)4-5-22(26-19)29-11-8-23(29)6-9-24-10-7-23/h2-5,12-14,24,30H,6-11H2,1H3
InChIKeyNVZBRWKAQQUUQR-UHFFFAOYSA-N
MW400.49 g/mol
LogP3.22
Rot. Bonds2

About 5-[6-(1,7-diazaspiro[3.5]nonan-1-yl)-1,5-naphthyridin-2-yl]-2-methylindazol-6-ol

5-[6-(1,7-diazaspiro[3.5]nonan-1-yl)-1,5-naphthyridin-2-yl]-2-methylindazol-6-ol (PubChem CID 162433370) has the molecular formula C23H24N6O and a molecular weight of 400.49 g/mol. Its IUPAC name is 5-[6-(1,7-diazaspiro[3.5]nonan-1-yl)-1,5-naphthyridin-2-yl]-2-methylindazol-6-ol.

Molecular Properties

Compound Name5-[6-(1,7-diazaspiro[3.5]nonan-1-yl)-1,5-naphthyridin-2-yl]-2-methylindazol-6-ol
PubChem CID162433370
Molecular FormulaC23H24N6O
Molecular Weight400.49 g/mol
Exact Mass400.20
IUPAC Name5-[6-(1,7-diazaspiro[3.5]nonan-1-yl)-1,5-naphthyridin-2-yl]-2-methylindazol-6-ol
SMILESCn1cc2cc(-c3ccc4nc(N5CCC56CCNCC6)ccc4n3)c(O)cc2n1
InChIInChI=1S/C23H24N6O/c1-28-14-15-12-16(21(30)13-20(15)27-28)17-2-3-19-18(25-17)4-5-22(26-19)29-11-8-23(29)6-9-24-10-7-23/h2-5,12-14,24,30H,6-11H2,1H3
InChIKeyNVZBRWKAQQUUQR-UHFFFAOYSA-N
XLogP3.22
TPSA79.10 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds2
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500400.49
LogP ≤ 53.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 5-[6-(1,7-diazaspiro[3.5]nonan-1-yl)-1,5-naphthyridin-2-yl]-2-methylindazol-6-ol?
The IUPAC name of 5-[6-(1,7-diazaspiro[3.5]nonan-1-yl)-1,5-naphthyridin-2-yl]-2-methylindazol-6-ol (CID 162433370) is 5-[6-(1,7-diazaspiro[3.5]nonan-1-yl)-1,5-naphthyridin-2-yl]-2-methylindazol-6-ol.
What is the SMILES notation for 5-[6-(1,7-diazaspiro[3.5]nonan-1-yl)-1,5-naphthyridin-2-yl]-2-methylindazol-6-ol?
The canonical SMILES for 5-[6-(1,7-diazaspiro[3.5]nonan-1-yl)-1,5-naphthyridin-2-yl]-2-methylindazol-6-ol is Cn1cc2cc(-c3ccc4nc(N5CCC56CCNCC6)ccc4n3)c(O)cc2n1.
What is the InChIKey of 5-[6-(1,7-diazaspiro[3.5]nonan-1-yl)-1,5-naphthyridin-2-yl]-2-methylindazol-6-ol?
The InChIKey is NVZBRWKAQQUUQR-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24N6O/c1-28-14-15-12-16(21(30)13-20(15)27-28)17-2-3-19-18(25-17)4-5-22(26-19)29-11-8-23(29)6-9-24-10-7-23/h2-5,12-14,24,30H,6-11H2,1H3.
What are the key properties of 5-[6-(1,7-diazaspiro[3.5]nonan-1-yl)-1,5-naphthyridin-2-yl]-2-methylindazol-6-ol?
5-[6-(1,7-diazaspiro[3.5]nonan-1-yl)-1,5-naphthyridin-2-yl]-2-methylindazol-6-ol has a molecular weight of 400.49 g/mol, XLogP of 3.22, 2 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[6-(1,7-diazaspiro[3.5]nonan-1-yl)-1,5-naphthyridin-2-yl]-2-methylindazol-6-ol is sourced from PubChem (CID 162433370), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).