N-[4-methoxy-3-(pyridin-3-ylmethoxy)phenyl]-4-morpholin-4-ylsulfonylbenzamide

C24H25N3O6S — CID 43069792

IUPACN-[4-methoxy-3-(pyridin-3-ylmethoxy)phenyl]-4-morpholin-4-ylsulfonylbenzamide
SMILESCOc1ccc(NC(=O)c2ccc(S(=O)(=O)N3CCOCC3)cc2)cc1OCc1cccnc1
InChIInChI=1S/C24H25N3O6S/c1-31-22-9-6-20(15-23(22)33-17-18-3-2-10-25-16-18)26-24(28)19-4-7-21(8-5-19)34(29,30)27-11-13-32-14-12-27/h2-10,15-16H,11-14,17H2,1H3,(H,26,28)
InChIKeyITIQIPLAVYQLNS-UHFFFAOYSA-N
MW483.55 g/mol
LogP2.94
Rot. Bonds8

About N-[4-methoxy-3-(pyridin-3-ylmethoxy)phenyl]-4-morpholin-4-ylsulfonylbenzamide

N-[4-methoxy-3-(pyridin-3-ylmethoxy)phenyl]-4-morpholin-4-ylsulfonylbenzamide (PubChem CID 43069792) has the molecular formula C24H25N3O6S and a molecular weight of 483.55 g/mol. Its IUPAC name is N-[4-methoxy-3-(pyridin-3-ylmethoxy)phenyl]-4-morpholin-4-ylsulfonylbenzamide.

Molecular Properties

Compound NameN-[4-methoxy-3-(pyridin-3-ylmethoxy)phenyl]-4-morpholin-4-ylsulfonylbenzamide
PubChem CID43069792
Molecular FormulaC24H25N3O6S
Molecular Weight483.55 g/mol
Exact Mass483.15
IUPAC NameN-[4-methoxy-3-(pyridin-3-ylmethoxy)phenyl]-4-morpholin-4-ylsulfonylbenzamide
SMILESCOc1ccc(NC(=O)c2ccc(S(=O)(=O)N3CCOCC3)cc2)cc1OCc1cccnc1
InChIInChI=1S/C24H25N3O6S/c1-31-22-9-6-20(15-23(22)33-17-18-3-2-10-25-16-18)26-24(28)19-4-7-21(8-5-19)34(29,30)27-11-13-32-14-12-27/h2-10,15-16H,11-14,17H2,1H3,(H,26,28)
InChIKeyITIQIPLAVYQLNS-UHFFFAOYSA-N
XLogP2.94
TPSA107.06 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds8
Heavy Atoms34
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500483.55
LogP ≤ 52.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

N-[4-methoxy-3-(pyridin-3-ylmethoxy)phenyl]-3-morpholin-4-ylsulfonylbenzamide
CID 43069830
N-(4-methoxy-3-piperidin-1-ylsulfonylphenyl)-4-(pyridin-3-ylmethoxy)benzamide
CID 39300329
3,4-diethoxy-N-[4-methoxy-3-(pyridin-3-ylmethoxy)phenyl]benzamide
CID 46426672
1-(benzenesulfonyl)-N-[4-methoxy-3-(pyridin-3-ylmethoxy)phenyl]piperidine-3-carboxamide
CID 46480295
N-[4-methoxy-3-(pyridin-3-ylmethoxy)phenyl]-4-(2,2,2-trifluoroethoxy)benzamide
CID 38628144
N-(4-methoxy-3-piperidin-1-ylsulfonylphenyl)-4-morpholin-4-ylsulfonylbenzamide
CID 100679263
N-(2-methoxy-5-morpholin-4-ylsulfonylphenyl)pyridine-4-carboxamide
CID 4852404
(2R)-N-[4-methoxy-3-(pyridin-3-ylmethoxy)phenyl]oxolane-2-carboxamide
CID 38625488
2-methoxy-5-morpholin-4-ylsulfonyl-N-[4-(pyridin-3-ylsulfamoyl)phenyl]benzamide
CID 43876086
3-(methoxymethyl)-N-(4-methoxy-3-morpholin-4-ylsulfonylphenyl)benzamide
CID 9322729
2-methoxy-5-morpholin-4-ylsulfonyl-N-(4-phenylmethoxyphenyl)benzamide
CID 27843834
4-tert-butyl-N-[2-[4-methoxy-3-(pyridin-3-ylmethoxy)anilino]-2-oxoethyl]benzamide
CID 55645199

Frequently Asked Questions

What is the IUPAC name of N-[4-methoxy-3-(pyridin-3-ylmethoxy)phenyl]-4-morpholin-4-ylsulfonylbenzamide?
The IUPAC name of N-[4-methoxy-3-(pyridin-3-ylmethoxy)phenyl]-4-morpholin-4-ylsulfonylbenzamide (CID 43069792) is N-[4-methoxy-3-(pyridin-3-ylmethoxy)phenyl]-4-morpholin-4-ylsulfonylbenzamide.
What is the SMILES notation for N-[4-methoxy-3-(pyridin-3-ylmethoxy)phenyl]-4-morpholin-4-ylsulfonylbenzamide?
The canonical SMILES for N-[4-methoxy-3-(pyridin-3-ylmethoxy)phenyl]-4-morpholin-4-ylsulfonylbenzamide is COc1ccc(NC(=O)c2ccc(S(=O)(=O)N3CCOCC3)cc2)cc1OCc1cccnc1.
What is the InChIKey of N-[4-methoxy-3-(pyridin-3-ylmethoxy)phenyl]-4-morpholin-4-ylsulfonylbenzamide?
The InChIKey is ITIQIPLAVYQLNS-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H25N3O6S/c1-31-22-9-6-20(15-23(22)33-17-18-3-2-10-25-16-18)26-24(28)19-4-7-21(8-5-19)34(29,30)27-11-13-32-14-12-27/h2-10,15-16H,11-14,17H2,1H3,(H,26,28).
What are the key properties of N-[4-methoxy-3-(pyridin-3-ylmethoxy)phenyl]-4-morpholin-4-ylsulfonylbenzamide?
N-[4-methoxy-3-(pyridin-3-ylmethoxy)phenyl]-4-morpholin-4-ylsulfonylbenzamide has a molecular weight of 483.55 g/mol, XLogP of 2.94, 8 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-methoxy-3-(pyridin-3-ylmethoxy)phenyl]-4-morpholin-4-ylsulfonylbenzamide is sourced from PubChem (CID 43069792), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).