4-chloro-2-methoxy-N-(4-piperidin-1-ylsulfonylphenyl)benzamide

C19H21ClN2O4S — CID 60594030

IUPAC4-chloro-2-methoxy-N-(4-piperidin-1-ylsulfonylphenyl)benzamide
SMILESCOc1cc(Cl)ccc1C(=O)Nc1ccc(S(=O)(=O)N2CCCCC2)cc1
InChIInChI=1S/C19H21ClN2O4S/c1-26-18-13-14(20)5-10-17(18)19(23)21-15-6-8-16(9-7-15)27(24,25)22-11-3-2-4-12-22/h5-10,13H,2-4,11-12H2,1H3,(H,21,23)
InChIKeyBZXGPJCOHYYQPK-UHFFFAOYSA-N
MW408.91 g/mol
LogP3.78
Rot. Bonds5

About 4-chloro-2-methoxy-N-(4-piperidin-1-ylsulfonylphenyl)benzamide

4-chloro-2-methoxy-N-(4-piperidin-1-ylsulfonylphenyl)benzamide (PubChem CID 60594030) has the molecular formula C19H21ClN2O4S and a molecular weight of 408.91 g/mol. Its IUPAC name is 4-chloro-2-methoxy-N-(4-piperidin-1-ylsulfonylphenyl)benzamide.

Molecular Properties

Compound Name4-chloro-2-methoxy-N-(4-piperidin-1-ylsulfonylphenyl)benzamide
PubChem CID60594030
Molecular FormulaC19H21ClN2O4S
Molecular Weight408.91 g/mol
Exact Mass408.09
IUPAC Name4-chloro-2-methoxy-N-(4-piperidin-1-ylsulfonylphenyl)benzamide
SMILESCOc1cc(Cl)ccc1C(=O)Nc1ccc(S(=O)(=O)N2CCCCC2)cc1
InChIInChI=1S/C19H21ClN2O4S/c1-26-18-13-14(20)5-10-17(18)19(23)21-15-6-8-16(9-7-15)27(24,25)22-11-3-2-4-12-22/h5-10,13H,2-4,11-12H2,1H3,(H,21,23)
InChIKeyBZXGPJCOHYYQPK-UHFFFAOYSA-N
XLogP3.78
TPSA75.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500408.91
LogP ≤ 53.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 4-chloro-2-methoxy-N-(4-piperidin-1-ylsulfonylphenyl)benzamide 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

N-[4-(azepan-1-ylsulfonyl)phenyl]-2,4-dichlorobenzamide
CID 1010211
2-methoxy-5-piperidin-1-ylsulfonyl-N-(4-pyrrolidin-1-ylsulfonylphenyl)benzamide
CID 28591050
N-[4-(azepan-1-ylsulfonyl)phenyl]-2-methoxy-5-pyrrolidin-1-ylsulfonylbenzamide
CID 28590945
2,5-dichloro-N-(4-pyrrolidin-1-ylsulfonylphenyl)benzamide
CID 3387472
5-(azepan-1-ylsulfonyl)-2-chloro-N-(3,4-dimethoxyphenyl)benzamide
CID 46387461
N-[4-(azepan-1-ylsulfonyl)phenyl]-5-fluoro-2-methoxybenzamide
CID 31118008
2-chloro-N-(3,4-dimethoxyphenyl)-5-piperidin-1-ylsulfonylbenzamide
CID 26364818
N-[4-(azepan-1-ylsulfonyl)phenyl]-3,5-dichloro-4-methoxybenzamide
CID 1296808
2-chloro-N-(3-chloro-4-methoxyphenyl)-5-pyrrolidin-1-ylsulfonylbenzamide
CID 26822918
N-[4-(azepan-1-ylsulfonyl)phenyl]-2,3-dimethoxybenzamide
CID 51556740
2,4,5-trimethyl-N-(4-pyrrolidin-1-ylsulfonylphenyl)benzamide
CID 100709394
N-(3-chloro-4-methylphenyl)-2-methoxy-5-piperidin-1-ylsulfonylbenzamide
CID 28591009

Frequently Asked Questions

What is the IUPAC name of 4-chloro-2-methoxy-N-(4-piperidin-1-ylsulfonylphenyl)benzamide?
The IUPAC name of 4-chloro-2-methoxy-N-(4-piperidin-1-ylsulfonylphenyl)benzamide (CID 60594030) is 4-chloro-2-methoxy-N-(4-piperidin-1-ylsulfonylphenyl)benzamide.
What is the SMILES notation for 4-chloro-2-methoxy-N-(4-piperidin-1-ylsulfonylphenyl)benzamide?
The canonical SMILES for 4-chloro-2-methoxy-N-(4-piperidin-1-ylsulfonylphenyl)benzamide is COc1cc(Cl)ccc1C(=O)Nc1ccc(S(=O)(=O)N2CCCCC2)cc1.
What is the InChIKey of 4-chloro-2-methoxy-N-(4-piperidin-1-ylsulfonylphenyl)benzamide?
The InChIKey is BZXGPJCOHYYQPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21ClN2O4S/c1-26-18-13-14(20)5-10-17(18)19(23)21-15-6-8-16(9-7-15)27(24,25)22-11-3-2-4-12-22/h5-10,13H,2-4,11-12H2,1H3,(H,21,23).
What are the key properties of 4-chloro-2-methoxy-N-(4-piperidin-1-ylsulfonylphenyl)benzamide?
4-chloro-2-methoxy-N-(4-piperidin-1-ylsulfonylphenyl)benzamide has a molecular weight of 408.91 g/mol, XLogP of 3.78, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-2-methoxy-N-(4-piperidin-1-ylsulfonylphenyl)benzamide is sourced from PubChem (CID 60594030), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).