4-(6-morpholin-4-yl-3-pyridinyl)spiro[3,5,13,17-tetrazatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,11(16)-pentaene-15,3'-azetidine]-12-one

C24H25N7O2 — CID 59558395

IUPAC4-(6-morpholin-4-yl-3-pyridinyl)spiro[3,5,13,17-tetrazatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,11(16)-pentaene-15,3'-azetidine]-12-one
SMILESO=C1NCC2(CNC2)c2[nH]c3c(c21)CCc1cnc(-c2ccc(N4CCOCC4)nc2)nc1-3
InChIInChI=1S/C24H25N7O2/c32-23-18-16-3-1-14-9-27-22(15-2-4-17(26-10-15)31-5-7-33-8-6-31)30-19(14)20(16)29-21(18)24(13-28-23)11-25-12-24/h2,4,9-10,25,29H,1,3,5-8,11-13H2,(H,28,32)
InChIKeyLNTQOALLMGFIHN-UHFFFAOYSA-N
MW443.51 g/mol
LogP1.05
Rot. Bonds2

About 4-(6-morpholin-4-yl-3-pyridinyl)spiro[3,5,13,17-tetrazatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,11(16)-pentaene-15,3'-azetidine]-12-one

4-(6-morpholin-4-yl-3-pyridinyl)spiro[3,5,13,17-tetrazatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,11(16)-pentaene-15,3'-azetidine]-12-one (PubChem CID 59558395) has the molecular formula C24H25N7O2 and a molecular weight of 443.51 g/mol. Its IUPAC name is 4-(6-morpholin-4-yl-3-pyridinyl)spiro[3,5,13,17-tetrazatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,11(16)-pentaene-15,3'-azetidine]-12-one.

Molecular Properties

Compound Name4-(6-morpholin-4-yl-3-pyridinyl)spiro[3,5,13,17-tetrazatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,11(16)-pentaene-15,3'-azetidine]-12-one
PubChem CID59558395
Molecular FormulaC24H25N7O2
Molecular Weight443.51 g/mol
Exact Mass443.21
IUPAC Name4-(6-morpholin-4-yl-3-pyridinyl)spiro[3,5,13,17-tetrazatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,11(16)-pentaene-15,3'-azetidine]-12-one
SMILESO=C1NCC2(CNC2)c2[nH]c3c(c21)CCc1cnc(-c2ccc(N4CCOCC4)nc2)nc1-3
InChIInChI=1S/C24H25N7O2/c32-23-18-16-3-1-14-9-27-22(15-2-4-17(26-10-15)31-5-7-33-8-6-31)30-19(14)20(16)29-21(18)24(13-28-23)11-25-12-24/h2,4,9-10,25,29H,1,3,5-8,11-13H2,(H,28,32)
InChIKeyLNTQOALLMGFIHN-UHFFFAOYSA-N
XLogP1.05
TPSA108.06 Ų
H-Bond Donors3
H-Bond Acceptors7
Rotatable Bonds2
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500443.51
LogP ≤ 51.05
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 107

Analyze 4-(6-morpholin-4-yl-3-pyridinyl)spiro[3,5,13,17-tetrazatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,11(16)-pentaene-15,3'-azetidine]-12-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1'-methyl-4-[4-(2-morpholin-4-ylethoxy)phenyl]spiro[3,5,13,17-tetrazatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,11(16)-pentaene-15,3'-azetidine]-12-one
CID 56666416
5-(12-oxospiro[3,5,13,17-tetrazatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,11(16)-pentaene-15,1'-cyclopropane]-4-yl)pyridine-3-carboxylic acid
CID 59558510
3-fluoro-4-(4-methylphenyl)spiro[5,13,17-triazatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,11(16)-pentaene-15,1'-cyclopropane]-12-one
CID 166461690
4-[3-amino-4-(2-morpholin-4-ylethoxy)phenyl]spiro[5,13,17-triazatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,11(16)-pentaene-15,1'-cyclopropane]-12-one
CID 89209008
1'-methyl-4-(4-propylphenyl)spiro[5,13,17-triazatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,11(16)-pentaene-15,3'-azetidine]-12-one
CID 166461534
4-[5-(4,6-dimorpholin-4-yl-1,3,5-triazin-2-yl)-2-pyridinyl]morpholine
CID 58507795
4-(6-morpholin-4-yl-3-pyridinyl)-2,3-dihydroisoindol-1-one
CID 175996415
8-[3-(1-aminocyclopropyl)-1-methylazetidin-3-yl]-2-[4-(2-morpholin-4-ylethoxy)phenyl]-6,9-dihydro-5H-pyrrolo[3,2-h]quinazoline-7-carboxylic acid
CID 66682665
2-[4-morpholin-2-yl-6-(6-morpholin-4-yl-3-pyridinyl)-1,3,5-triazin-2-yl]morpholine
CID 67402294
4-(5-pyridin-4-yl-2-pyridinyl)morpholine
CID 10377044
6-methyl-2-(6-morpholin-4-yl-3-pyridinyl)pyrimidin-4-amine
CID 117085161
2-[2-(6-piperazin-1-yl-3-pyridinyl)-4-pyridinyl]spiro[5,6-dihydro-1H-pyrrolo[3,2-c]pyridine-7,1'-cyclopropane]-4-one
CID 166461394

Frequently Asked Questions

What is the IUPAC name of 4-(6-morpholin-4-yl-3-pyridinyl)spiro[3,5,13,17-tetrazatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,11(16)-pentaene-15,3'-azetidine]-12-one?
The IUPAC name of 4-(6-morpholin-4-yl-3-pyridinyl)spiro[3,5,13,17-tetrazatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,11(16)-pentaene-15,3'-azetidine]-12-one (CID 59558395) is 4-(6-morpholin-4-yl-3-pyridinyl)spiro[3,5,13,17-tetrazatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,11(16)-pentaene-15,3'-azetidine]-12-one.
What is the SMILES notation for 4-(6-morpholin-4-yl-3-pyridinyl)spiro[3,5,13,17-tetrazatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,11(16)-pentaene-15,3'-azetidine]-12-one?
The canonical SMILES for 4-(6-morpholin-4-yl-3-pyridinyl)spiro[3,5,13,17-tetrazatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,11(16)-pentaene-15,3'-azetidine]-12-one is O=C1NCC2(CNC2)c2[nH]c3c(c21)CCc1cnc(-c2ccc(N4CCOCC4)nc2)nc1-3.
What is the InChIKey of 4-(6-morpholin-4-yl-3-pyridinyl)spiro[3,5,13,17-tetrazatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,11(16)-pentaene-15,3'-azetidine]-12-one?
The InChIKey is LNTQOALLMGFIHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H25N7O2/c32-23-18-16-3-1-14-9-27-22(15-2-4-17(26-10-15)31-5-7-33-8-6-31)30-19(14)20(16)29-21(18)24(13-28-23)11-25-12-24/h2,4,9-10,25,29H,1,3,5-8,11-13H2,(H,28,32).
What are the key properties of 4-(6-morpholin-4-yl-3-pyridinyl)spiro[3,5,13,17-tetrazatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,11(16)-pentaene-15,3'-azetidine]-12-one?
4-(6-morpholin-4-yl-3-pyridinyl)spiro[3,5,13,17-tetrazatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,11(16)-pentaene-15,3'-azetidine]-12-one has a molecular weight of 443.51 g/mol, XLogP of 1.05, 2 rotatable bonds, 3 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(6-morpholin-4-yl-3-pyridinyl)spiro[3,5,13,17-tetrazatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,11(16)-pentaene-15,3'-azetidine]-12-one is sourced from PubChem (CID 59558395), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).