4-(8-pyrazolidin-3-yl-4-quinolin-3-yl-1,7-naphthyridin-2-yl)morpholine

C24H24N6O — CID 135121287

IUPAC4-(8-pyrazolidin-3-yl-4-quinolin-3-yl-1,7-naphthyridin-2-yl)morpholine
SMILESc1ccc2ncc(-c3cc(N4CCOCC4)nc4c(C5CCNN5)nccc34)cc2c1
InChIInChI=1S/C24H24N6O/c1-2-4-20-16(3-1)13-17(15-26-20)19-14-22(30-9-11-31-12-10-30)28-23-18(19)5-7-25-24(23)21-6-8-27-29-21/h1-5,7,13-15,21,27,29H,6,8-12H2
InChIKeyNXGNKRKVOGGUDT-UHFFFAOYSA-N
MW412.50 g/mol
LogP3.22
Rot. Bonds3

About 4-(8-pyrazolidin-3-yl-4-quinolin-3-yl-1,7-naphthyridin-2-yl)morpholine

4-(8-pyrazolidin-3-yl-4-quinolin-3-yl-1,7-naphthyridin-2-yl)morpholine (PubChem CID 135121287) has the molecular formula C24H24N6O and a molecular weight of 412.50 g/mol. Its IUPAC name is 4-(8-pyrazolidin-3-yl-4-quinolin-3-yl-1,7-naphthyridin-2-yl)morpholine.

Molecular Properties

Compound Name4-(8-pyrazolidin-3-yl-4-quinolin-3-yl-1,7-naphthyridin-2-yl)morpholine
PubChem CID135121287
Molecular FormulaC24H24N6O
Molecular Weight412.50 g/mol
Exact Mass412.20
IUPAC Name4-(8-pyrazolidin-3-yl-4-quinolin-3-yl-1,7-naphthyridin-2-yl)morpholine
SMILESc1ccc2ncc(-c3cc(N4CCOCC4)nc4c(C5CCNN5)nccc34)cc2c1
InChIInChI=1S/C24H24N6O/c1-2-4-20-16(3-1)13-17(15-26-20)19-14-22(30-9-11-31-12-10-30)28-23-18(19)5-7-25-24(23)21-6-8-27-29-21/h1-5,7,13-15,21,27,29H,6,8-12H2
InChIKeyNXGNKRKVOGGUDT-UHFFFAOYSA-N
XLogP3.22
TPSA75.20 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500412.50
LogP ≤ 53.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 4-(8-pyrazolidin-3-yl-4-quinolin-3-yl-1,7-naphthyridin-2-yl)morpholine?
The IUPAC name of 4-(8-pyrazolidin-3-yl-4-quinolin-3-yl-1,7-naphthyridin-2-yl)morpholine (CID 135121287) is 4-(8-pyrazolidin-3-yl-4-quinolin-3-yl-1,7-naphthyridin-2-yl)morpholine.
What is the SMILES notation for 4-(8-pyrazolidin-3-yl-4-quinolin-3-yl-1,7-naphthyridin-2-yl)morpholine?
The canonical SMILES for 4-(8-pyrazolidin-3-yl-4-quinolin-3-yl-1,7-naphthyridin-2-yl)morpholine is c1ccc2ncc(-c3cc(N4CCOCC4)nc4c(C5CCNN5)nccc34)cc2c1.
What is the InChIKey of 4-(8-pyrazolidin-3-yl-4-quinolin-3-yl-1,7-naphthyridin-2-yl)morpholine?
The InChIKey is NXGNKRKVOGGUDT-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H24N6O/c1-2-4-20-16(3-1)13-17(15-26-20)19-14-22(30-9-11-31-12-10-30)28-23-18(19)5-7-25-24(23)21-6-8-27-29-21/h1-5,7,13-15,21,27,29H,6,8-12H2.
What are the key properties of 4-(8-pyrazolidin-3-yl-4-quinolin-3-yl-1,7-naphthyridin-2-yl)morpholine?
4-(8-pyrazolidin-3-yl-4-quinolin-3-yl-1,7-naphthyridin-2-yl)morpholine has a molecular weight of 412.50 g/mol, XLogP of 3.22, 3 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(8-pyrazolidin-3-yl-4-quinolin-3-yl-1,7-naphthyridin-2-yl)morpholine is sourced from PubChem (CID 135121287), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).