N-(2-methoxyphenyl)-2-(methylamino)-5-piperidin-1-ylsulfonylbenzamide

C20H25N3O4S — CID 146301697

IUPACN-(2-methoxyphenyl)-2-(methylamino)-5-piperidin-1-ylsulfonylbenzamide
SMILESCNc1ccc(S(=O)(=O)N2CCCCC2)cc1C(=O)Nc1ccccc1OC
InChIInChI=1S/C20H25N3O4S/c1-21-17-11-10-15(28(25,26)23-12-6-3-7-13-23)14-16(17)20(24)22-18-8-4-5-9-19(18)27-2/h4-5,8-11,14,21H,3,6-7,12-13H2,1-2H3,(H,22,24)
InChIKeyHZUDEIINLQPOGB-UHFFFAOYSA-N
MW403.50 g/mol
LogP3.16
Rot. Bonds6

About N-(2-methoxyphenyl)-2-(methylamino)-5-piperidin-1-ylsulfonylbenzamide

N-(2-methoxyphenyl)-2-(methylamino)-5-piperidin-1-ylsulfonylbenzamide (PubChem CID 146301697) has the molecular formula C20H25N3O4S and a molecular weight of 403.50 g/mol. Its IUPAC name is N-(2-methoxyphenyl)-2-(methylamino)-5-piperidin-1-ylsulfonylbenzamide.

Molecular Properties

Compound NameN-(2-methoxyphenyl)-2-(methylamino)-5-piperidin-1-ylsulfonylbenzamide
PubChem CID146301697
Molecular FormulaC20H25N3O4S
Molecular Weight403.50 g/mol
Exact Mass403.16
IUPAC NameN-(2-methoxyphenyl)-2-(methylamino)-5-piperidin-1-ylsulfonylbenzamide
SMILESCNc1ccc(S(=O)(=O)N2CCCCC2)cc1C(=O)Nc1ccccc1OC
InChIInChI=1S/C20H25N3O4S/c1-21-17-11-10-15(28(25,26)23-12-6-3-7-13-23)14-16(17)20(24)22-18-8-4-5-9-19(18)27-2/h4-5,8-11,14,21H,3,6-7,12-13H2,1-2H3,(H,22,24)
InChIKeyHZUDEIINLQPOGB-UHFFFAOYSA-N
XLogP3.16
TPSA87.74 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500403.50
LogP ≤ 53.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

5-(azepan-1-ylsulfonyl)-2-methoxy-N-(2-methylphenyl)benzamide
CID 7946811
2-fluoro-N-(2-methoxy-5-piperidin-1-ylsulfonylphenyl)benzamide
CID 4799979
2-iodo-N-(2-methoxy-5-pyrrolidin-1-ylsulfonylphenyl)benzamide
CID 38020238
N-(2-methoxy-5-piperidin-1-ylsulfonylphenyl)-2-methylsulfanylbenzamide
CID 8746944
2-methoxy-N-(2-methoxy-5-piperidin-1-ylsulfonylphenyl)-5-methylbenzamide
CID 9046765
[2-(2-methoxyanilino)-2-oxoethyl] 2-chloro-5-piperidin-1-ylsulfonylbenzoate
CID 2599302
N-(2-ethoxyphenyl)-2-fluoro-5-piperidin-1-ylsulfonylbenzamide
CID 3585656
N-(5-chloro-2-methoxyphenyl)-2-methyl-5-piperidin-1-ylsulfonylbenzamide
CID 4781950
5-(azepan-1-ylsulfonyl)-N-[2-(butan-2-ylcarbamoyl)phenyl]-2-methoxybenzamide
CID 43882697
5-(azepan-1-ylsulfonyl)-2-methoxy-N-quinolin-5-ylbenzamide
CID 55342989
N-[4-(azepan-1-ylsulfonyl)phenyl]-2-methoxy-5-pyrrolidin-1-ylsulfonylbenzamide
CID 28590945
5-(azepan-1-ylsulfonyl)-2-methyl-N-(2-methylphenyl)benzamide
CID 53281813

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyphenyl)-2-(methylamino)-5-piperidin-1-ylsulfonylbenzamide?
The IUPAC name of N-(2-methoxyphenyl)-2-(methylamino)-5-piperidin-1-ylsulfonylbenzamide (CID 146301697) is N-(2-methoxyphenyl)-2-(methylamino)-5-piperidin-1-ylsulfonylbenzamide.
What is the SMILES notation for N-(2-methoxyphenyl)-2-(methylamino)-5-piperidin-1-ylsulfonylbenzamide?
The canonical SMILES for N-(2-methoxyphenyl)-2-(methylamino)-5-piperidin-1-ylsulfonylbenzamide is CNc1ccc(S(=O)(=O)N2CCCCC2)cc1C(=O)Nc1ccccc1OC.
What is the InChIKey of N-(2-methoxyphenyl)-2-(methylamino)-5-piperidin-1-ylsulfonylbenzamide?
The InChIKey is HZUDEIINLQPOGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25N3O4S/c1-21-17-11-10-15(28(25,26)23-12-6-3-7-13-23)14-16(17)20(24)22-18-8-4-5-9-19(18)27-2/h4-5,8-11,14,21H,3,6-7,12-13H2,1-2H3,(H,22,24).
What are the key properties of N-(2-methoxyphenyl)-2-(methylamino)-5-piperidin-1-ylsulfonylbenzamide?
N-(2-methoxyphenyl)-2-(methylamino)-5-piperidin-1-ylsulfonylbenzamide has a molecular weight of 403.50 g/mol, XLogP of 3.16, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyphenyl)-2-(methylamino)-5-piperidin-1-ylsulfonylbenzamide is sourced from PubChem (CID 146301697), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).