4-[4-(1H-indol-6-yl)-8-pyrazolidin-3-yl-1,7-naphthyridin-2-yl]morpholine

C23H24N6O — CID 135121259

IUPAC4-[4-(1H-indol-6-yl)-8-pyrazolidin-3-yl-1,7-naphthyridin-2-yl]morpholine
SMILESc1cc2c(-c3ccc4cc[nH]c4c3)cc(N3CCOCC3)nc2c(C2CCNN2)n1
InChIInChI=1S/C23H24N6O/c1-2-16(13-20-15(1)3-6-24-20)18-14-21(29-9-11-30-12-10-29)27-22-17(18)4-7-25-23(22)19-5-8-26-28-19/h1-4,6-7,13-14,19,24,26,28H,5,8-12H2
InChIKeyWMTOXTRDKQHNSX-UHFFFAOYSA-N
MW400.49 g/mol
LogP3.15
Rot. Bonds3

About 4-[4-(1H-indol-6-yl)-8-pyrazolidin-3-yl-1,7-naphthyridin-2-yl]morpholine

4-[4-(1H-indol-6-yl)-8-pyrazolidin-3-yl-1,7-naphthyridin-2-yl]morpholine (PubChem CID 135121259) has the molecular formula C23H24N6O and a molecular weight of 400.49 g/mol. Its IUPAC name is 4-[4-(1H-indol-6-yl)-8-pyrazolidin-3-yl-1,7-naphthyridin-2-yl]morpholine.

Molecular Properties

Compound Name4-[4-(1H-indol-6-yl)-8-pyrazolidin-3-yl-1,7-naphthyridin-2-yl]morpholine
PubChem CID135121259
Molecular FormulaC23H24N6O
Molecular Weight400.49 g/mol
Exact Mass400.20
IUPAC Name4-[4-(1H-indol-6-yl)-8-pyrazolidin-3-yl-1,7-naphthyridin-2-yl]morpholine
SMILESc1cc2c(-c3ccc4cc[nH]c4c3)cc(N3CCOCC3)nc2c(C2CCNN2)n1
InChIInChI=1S/C23H24N6O/c1-2-16(13-20-15(1)3-6-24-20)18-14-21(29-9-11-30-12-10-29)27-22-17(18)4-7-25-23(22)19-5-8-26-28-19/h1-4,6-7,13-14,19,24,26,28H,5,8-12H2
InChIKeyWMTOXTRDKQHNSX-UHFFFAOYSA-N
XLogP3.15
TPSA78.10 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms30
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500400.49
LogP ≤ 53.15
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 4-[4-(1H-indol-6-yl)-8-pyrazolidin-3-yl-1,7-naphthyridin-2-yl]morpholine?
The IUPAC name of 4-[4-(1H-indol-6-yl)-8-pyrazolidin-3-yl-1,7-naphthyridin-2-yl]morpholine (CID 135121259) is 4-[4-(1H-indol-6-yl)-8-pyrazolidin-3-yl-1,7-naphthyridin-2-yl]morpholine.
What is the SMILES notation for 4-[4-(1H-indol-6-yl)-8-pyrazolidin-3-yl-1,7-naphthyridin-2-yl]morpholine?
The canonical SMILES for 4-[4-(1H-indol-6-yl)-8-pyrazolidin-3-yl-1,7-naphthyridin-2-yl]morpholine is c1cc2c(-c3ccc4cc[nH]c4c3)cc(N3CCOCC3)nc2c(C2CCNN2)n1.
What is the InChIKey of 4-[4-(1H-indol-6-yl)-8-pyrazolidin-3-yl-1,7-naphthyridin-2-yl]morpholine?
The InChIKey is WMTOXTRDKQHNSX-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24N6O/c1-2-16(13-20-15(1)3-6-24-20)18-14-21(29-9-11-30-12-10-29)27-22-17(18)4-7-25-23(22)19-5-8-26-28-19/h1-4,6-7,13-14,19,24,26,28H,5,8-12H2.
What are the key properties of 4-[4-(1H-indol-6-yl)-8-pyrazolidin-3-yl-1,7-naphthyridin-2-yl]morpholine?
4-[4-(1H-indol-6-yl)-8-pyrazolidin-3-yl-1,7-naphthyridin-2-yl]morpholine has a molecular weight of 400.49 g/mol, XLogP of 3.15, 3 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[4-(1H-indol-6-yl)-8-pyrazolidin-3-yl-1,7-naphthyridin-2-yl]morpholine is sourced from PubChem (CID 135121259), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).