N-(2-methoxy-5-piperidin-1-ylsulfonylphenyl)-4-(oxolan-2-ylmethoxy)benzamide

C24H30N2O6S — CID 4312919

IUPACN-(2-methoxy-5-piperidin-1-ylsulfonylphenyl)-4-(oxolan-2-ylmethoxy)benzamide
SMILESCOc1ccc(S(=O)(=O)N2CCCCC2)cc1NC(=O)c1ccc(OCC2CCCO2)cc1
InChIInChI=1S/C24H30N2O6S/c1-30-23-12-11-21(33(28,29)26-13-3-2-4-14-26)16-22(23)25-24(27)18-7-9-19(10-8-18)32-17-20-6-5-15-31-20/h7-12,16,20H,2-6,13-15,17H2,1H3,(H,25,27)
InChIKeyJQKXENAMQDYILM-UHFFFAOYSA-N
MW474.58 g/mol
LogP3.68
Rot. Bonds8

About N-(2-methoxy-5-piperidin-1-ylsulfonylphenyl)-4-(oxolan-2-ylmethoxy)benzamide

N-(2-methoxy-5-piperidin-1-ylsulfonylphenyl)-4-(oxolan-2-ylmethoxy)benzamide (PubChem CID 4312919) has the molecular formula C24H30N2O6S and a molecular weight of 474.58 g/mol. Its IUPAC name is N-(2-methoxy-5-piperidin-1-ylsulfonylphenyl)-4-(oxolan-2-ylmethoxy)benzamide.

Molecular Properties

Compound NameN-(2-methoxy-5-piperidin-1-ylsulfonylphenyl)-4-(oxolan-2-ylmethoxy)benzamide
PubChem CID4312919
Molecular FormulaC24H30N2O6S
Molecular Weight474.58 g/mol
Exact Mass474.18
IUPAC NameN-(2-methoxy-5-piperidin-1-ylsulfonylphenyl)-4-(oxolan-2-ylmethoxy)benzamide
SMILESCOc1ccc(S(=O)(=O)N2CCCCC2)cc1NC(=O)c1ccc(OCC2CCCO2)cc1
InChIInChI=1S/C24H30N2O6S/c1-30-23-12-11-21(33(28,29)26-13-3-2-4-14-26)16-22(23)25-24(27)18-7-9-19(10-8-18)32-17-20-6-5-15-31-20/h7-12,16,20H,2-6,13-15,17H2,1H3,(H,25,27)
InChIKeyJQKXENAMQDYILM-UHFFFAOYSA-N
XLogP3.68
TPSA94.17 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500474.58
LogP ≤ 53.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-(2-methoxy-5-morpholin-4-ylsulfonylphenyl)-4-(oxolan-2-ylmethoxy)benzamide
CID 42993641
N-(2-methoxy-5-piperidin-1-ylsulfonylphenyl)-3-(oxolan-2-ylmethoxy)benzamide
CID 24633586
4-(oxolan-2-ylmethoxy)-N-(3-pyrrolidin-1-ylsulfonylphenyl)benzamide
CID 4314126
1-[5-(azepan-1-ylsulfonyl)-2-methoxyphenyl]-3-[[(2S)-oxolan-2-yl]methyl]thiourea
CID 8660108
N-[5-(azepan-1-ylsulfonyl)-2-methoxyphenyl]-4-(dimethylsulfamoyl)benzamide
CID 3963997
1-(2-methoxy-5-pyrrolidin-1-ylsulfonylphenyl)-3-[[(2R)-oxolan-2-yl]methyl]thiourea
CID 100567444
3,4,5-trimethoxy-N-(2-methoxy-5-pyrrolidin-1-ylsulfonylphenyl)benzamide
CID 99952849
N-(2-methoxy-5-piperidin-1-ylsulfonylphenyl)-4-propan-2-ylbenzamide
CID 26065836
N-(2-methoxy-5-piperidin-1-ylsulfonylphenyl)-4-methyl-3-piperidin-1-ylsulfonylbenzamide
CID 4849595
N-[5-(azepan-1-ylsulfonyl)-2-methoxyphenyl]-3,5-dichlorobenzamide
CID 26206912
N-(2-methoxy-5-piperidin-1-ylsulfonylphenyl)-1,3-benzodioxole-5-carboxamide
CID 5187446
4-(difluoromethoxy)-3-methoxy-N-(2-methoxy-5-piperidin-1-ylsulfonylphenyl)benzamide
CID 26065662

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxy-5-piperidin-1-ylsulfonylphenyl)-4-(oxolan-2-ylmethoxy)benzamide?
The IUPAC name of N-(2-methoxy-5-piperidin-1-ylsulfonylphenyl)-4-(oxolan-2-ylmethoxy)benzamide (CID 4312919) is N-(2-methoxy-5-piperidin-1-ylsulfonylphenyl)-4-(oxolan-2-ylmethoxy)benzamide.
What is the SMILES notation for N-(2-methoxy-5-piperidin-1-ylsulfonylphenyl)-4-(oxolan-2-ylmethoxy)benzamide?
The canonical SMILES for N-(2-methoxy-5-piperidin-1-ylsulfonylphenyl)-4-(oxolan-2-ylmethoxy)benzamide is COc1ccc(S(=O)(=O)N2CCCCC2)cc1NC(=O)c1ccc(OCC2CCCO2)cc1.
What is the InChIKey of N-(2-methoxy-5-piperidin-1-ylsulfonylphenyl)-4-(oxolan-2-ylmethoxy)benzamide?
The InChIKey is JQKXENAMQDYILM-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H30N2O6S/c1-30-23-12-11-21(33(28,29)26-13-3-2-4-14-26)16-22(23)25-24(27)18-7-9-19(10-8-18)32-17-20-6-5-15-31-20/h7-12,16,20H,2-6,13-15,17H2,1H3,(H,25,27).
What are the key properties of N-(2-methoxy-5-piperidin-1-ylsulfonylphenyl)-4-(oxolan-2-ylmethoxy)benzamide?
N-(2-methoxy-5-piperidin-1-ylsulfonylphenyl)-4-(oxolan-2-ylmethoxy)benzamide has a molecular weight of 474.58 g/mol, XLogP of 3.68, 8 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxy-5-piperidin-1-ylsulfonylphenyl)-4-(oxolan-2-ylmethoxy)benzamide is sourced from PubChem (CID 4312919), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).