4-[4-[2-[2-(4-methoxy-2-pyridinyl)ethyl]-1H-imidazo[4,5-b]pyridin-6-yl]phenyl]sulfonylmorpholine

C24H25N5O4S — CID 11202425

IUPAC4-[4-[2-[2-(4-methoxy-2-pyridinyl)ethyl]-1H-imidazo[4,5-b]pyridin-6-yl]phenyl]sulfonylmorpholine
SMILESCOc1ccnc(CCc2nc3ncc(-c4ccc(S(=O)(=O)N5CCOCC5)cc4)cc3[nH]2)c1
InChIInChI=1S/C24H25N5O4S/c1-32-20-8-9-25-19(15-20)4-7-23-27-22-14-18(16-26-24(22)28-23)17-2-5-21(6-3-17)34(30,31)29-10-12-33-13-11-29/h2-3,5-6,8-9,14-16H,4,7,10-13H2,1H3,(H,26,27,28)
InChIKeyRLALJVXOXTVMIQ-UHFFFAOYSA-N
MW479.56 g/mol
LogP2.83
Rot. Bonds7

About 4-[4-[2-[2-(4-methoxy-2-pyridinyl)ethyl]-1H-imidazo[4,5-b]pyridin-6-yl]phenyl]sulfonylmorpholine

4-[4-[2-[2-(4-methoxy-2-pyridinyl)ethyl]-1H-imidazo[4,5-b]pyridin-6-yl]phenyl]sulfonylmorpholine (PubChem CID 11202425) has the molecular formula C24H25N5O4S and a molecular weight of 479.56 g/mol. Its IUPAC name is 4-[4-[2-[2-(4-methoxy-2-pyridinyl)ethyl]-1H-imidazo[4,5-b]pyridin-6-yl]phenyl]sulfonylmorpholine.

Molecular Properties

Compound Name4-[4-[2-[2-(4-methoxy-2-pyridinyl)ethyl]-1H-imidazo[4,5-b]pyridin-6-yl]phenyl]sulfonylmorpholine
PubChem CID11202425
Molecular FormulaC24H25N5O4S
Molecular Weight479.56 g/mol
Exact Mass479.16
IUPAC Name4-[4-[2-[2-(4-methoxy-2-pyridinyl)ethyl]-1H-imidazo[4,5-b]pyridin-6-yl]phenyl]sulfonylmorpholine
SMILESCOc1ccnc(CCc2nc3ncc(-c4ccc(S(=O)(=O)N5CCOCC5)cc4)cc3[nH]2)c1
InChIInChI=1S/C24H25N5O4S/c1-32-20-8-9-25-19(15-20)4-7-23-27-22-14-18(16-26-24(22)28-23)17-2-5-21(6-3-17)34(30,31)29-10-12-33-13-11-29/h2-3,5-6,8-9,14-16H,4,7,10-13H2,1H3,(H,26,27,28)
InChIKeyRLALJVXOXTVMIQ-UHFFFAOYSA-N
XLogP2.83
TPSA110.30 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds7
Heavy Atoms34
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500479.56
LogP ≤ 52.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze 4-[4-[2-[2-(4-methoxy-2-pyridinyl)ethyl]-1H-imidazo[4,5-b]pyridin-6-yl]phenyl]sulfonylmorpholine with MolForge

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Related Compounds

6-[4-[4-(2,6-dimethylphenyl)piperazin-1-yl]sulfonylphenyl]-2-[2-(4-methoxy-2-pyridinyl)ethyl]-1H-imidazo[4,5-b]pyridine
CID 11786587
4-[4-[5-(4-methoxyphenyl)-1,3-oxazol-2-yl]phenyl]sulfonylmorpholine
CID 3570882
4-[4-(4-methoxy-2-morpholin-4-ylsulfonylphenyl)phenyl]sulfonylmorpholine
CID 71671443
4-[4-[5-(3,5-dimethoxyphenyl)-1,2,4-oxadiazol-3-yl]phenyl]sulfonylmorpholine
CID 53075372
4-[4-[5-[(3-methoxyphenyl)methyl]-1,2,4-oxadiazol-3-yl]phenyl]sulfonylmorpholine
CID 53075377
6-[4-(azetidin-1-ylsulfonyl)phenyl]-1H-imidazo[4,5-b]pyridine
CID 91214113
1-(2,6-dimethylphenyl)-4-[4-[6-[2-(1H-imidazol-2-yl)ethyl]-4-methoxy-2-pyridinyl]phenyl]sulfonylpiperazine
CID 69288613
N-[2-(4-methoxyphenyl)ethyl]-5-morpholin-4-ylsulfonylpyridin-2-amine
CID 9281322
6-(4-piperidin-1-ylsulfonylphenyl)-1H-imidazo[4,5-b]pyridine
CID 91598920
4-[4-(6-methyl-1H-benzimidazol-2-yl)phenyl]sulfonylmorpholine
CID 103597241
4-[[6-[4-(4-methoxyphenyl)piperazin-1-yl]-3-pyridinyl]sulfonyl]morpholine
CID 9311875
8,8-dimethyl-2-(4-morpholin-4-ylsulfonylphenyl)-5,7-dihydro-1H-imidazo[4,5-g]quinolin-6-one
CID 19896862

Frequently Asked Questions

What is the IUPAC name of 4-[4-[2-[2-(4-methoxy-2-pyridinyl)ethyl]-1H-imidazo[4,5-b]pyridin-6-yl]phenyl]sulfonylmorpholine?
The IUPAC name of 4-[4-[2-[2-(4-methoxy-2-pyridinyl)ethyl]-1H-imidazo[4,5-b]pyridin-6-yl]phenyl]sulfonylmorpholine (CID 11202425) is 4-[4-[2-[2-(4-methoxy-2-pyridinyl)ethyl]-1H-imidazo[4,5-b]pyridin-6-yl]phenyl]sulfonylmorpholine.
What is the SMILES notation for 4-[4-[2-[2-(4-methoxy-2-pyridinyl)ethyl]-1H-imidazo[4,5-b]pyridin-6-yl]phenyl]sulfonylmorpholine?
The canonical SMILES for 4-[4-[2-[2-(4-methoxy-2-pyridinyl)ethyl]-1H-imidazo[4,5-b]pyridin-6-yl]phenyl]sulfonylmorpholine is COc1ccnc(CCc2nc3ncc(-c4ccc(S(=O)(=O)N5CCOCC5)cc4)cc3[nH]2)c1.
What is the InChIKey of 4-[4-[2-[2-(4-methoxy-2-pyridinyl)ethyl]-1H-imidazo[4,5-b]pyridin-6-yl]phenyl]sulfonylmorpholine?
The InChIKey is RLALJVXOXTVMIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H25N5O4S/c1-32-20-8-9-25-19(15-20)4-7-23-27-22-14-18(16-26-24(22)28-23)17-2-5-21(6-3-17)34(30,31)29-10-12-33-13-11-29/h2-3,5-6,8-9,14-16H,4,7,10-13H2,1H3,(H,26,27,28).
What are the key properties of 4-[4-[2-[2-(4-methoxy-2-pyridinyl)ethyl]-1H-imidazo[4,5-b]pyridin-6-yl]phenyl]sulfonylmorpholine?
4-[4-[2-[2-(4-methoxy-2-pyridinyl)ethyl]-1H-imidazo[4,5-b]pyridin-6-yl]phenyl]sulfonylmorpholine has a molecular weight of 479.56 g/mol, XLogP of 2.83, 7 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[4-[2-[2-(4-methoxy-2-pyridinyl)ethyl]-1H-imidazo[4,5-b]pyridin-6-yl]phenyl]sulfonylmorpholine is sourced from PubChem (CID 11202425), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).