N-cyclohexyl-2-(N-(4-methoxyphenyl)sulfonylanilino)acetamide

C21H26N2O4S — CID 1100054

IUPACN-cyclohexyl-2-(N-(4-methoxyphenyl)sulfonylanilino)acetamide
SMILESCOc1ccc(S(=O)(=O)N(CC(=O)NC2CCCCC2)c2ccccc2)cc1
InChIInChI=1S/C21H26N2O4S/c1-27-19-12-14-20(15-13-19)28(25,26)23(18-10-6-3-7-11-18)16-21(24)22-17-8-4-2-5-9-17/h3,6-7,10-15,17H,2,4-5,8-9,16H2,1H3,(H,22,24)
InChIKeyXCMBXHWYMKOBIB-UHFFFAOYSA-N
MW402.52 g/mol
LogP3.34
Rot. Bonds7

About N-cyclohexyl-2-(N-(4-methoxyphenyl)sulfonylanilino)acetamide

N-cyclohexyl-2-(N-(4-methoxyphenyl)sulfonylanilino)acetamide (PubChem CID 1100054) has the molecular formula C21H26N2O4S and a molecular weight of 402.52 g/mol. Its IUPAC name is N-cyclohexyl-2-(N-(4-methoxyphenyl)sulfonylanilino)acetamide.

Molecular Properties

Compound NameN-cyclohexyl-2-(N-(4-methoxyphenyl)sulfonylanilino)acetamide
PubChem CID1100054
Molecular FormulaC21H26N2O4S
Molecular Weight402.52 g/mol
Exact Mass402.16
IUPAC NameN-cyclohexyl-2-(N-(4-methoxyphenyl)sulfonylanilino)acetamide
SMILESCOc1ccc(S(=O)(=O)N(CC(=O)NC2CCCCC2)c2ccccc2)cc1
InChIInChI=1S/C21H26N2O4S/c1-27-19-12-14-20(15-13-19)28(25,26)23(18-10-6-3-7-11-18)16-21(24)22-17-8-4-2-5-9-17/h3,6-7,10-15,17H,2,4-5,8-9,16H2,1H3,(H,22,24)
InChIKeyXCMBXHWYMKOBIB-UHFFFAOYSA-N
XLogP3.34
TPSA75.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500402.52
LogP ≤ 53.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-cyclohexyl-2-(N-(4-methoxyphenyl)sulfonylanilino)acetamide 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

2-[N-(benzenesulfonyl)anilino]-N-cyclohexylacetamide
CID 555477
N-cyclohexyl-2-(2-methoxy-N-(4-methoxyphenyl)sulfonylanilino)acetamide
CID 53280380
2-[N-(benzenesulfonyl)-4-ethoxyanilino]-N-cyclohexylacetamide
CID 1141877
N-cycloheptyl-2-(N-(4-fluorophenyl)sulfonylanilino)acetamide
CID 2982325
2-[N-(benzenesulfonyl)-2,4-dimethoxyanilino]-N-cyclohexylacetamide
CID 1100043
N-cycloheptyl-2-(4-methoxy-N-methylsulfonylanilino)acetamide
CID 113155209
2-[[2-[N-(benzenesulfonyl)-4-methoxyanilino]acetyl]amino]-N-cyclohexylbenzamide
CID 126035456
2-[N-(benzenesulfonyl)-2-methoxyanilino]-N-cyclopentylacetamide
CID 3139224
N-cyclopentyl-2-(4-methoxy-N-[(E)-2-phenylethenyl]sulfonylanilino)acetamide
CID 30883132
(2S)-2-[(3-chlorophenyl)methyl-[2-(N-(4-methoxyphenyl)sulfonylanilino)acetyl]amino]-N-cyclohexylpropanamide
CID 100550791
2-[N-(benzenesulfonyl)-3-bromoanilino]-N-cycloheptylacetamide
CID 1320768
2-[N-(benzenesulfonyl)-3,5-dimethylanilino]-N-cyclopentylacetamide
CID 51345206

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-2-(N-(4-methoxyphenyl)sulfonylanilino)acetamide?
The IUPAC name of N-cyclohexyl-2-(N-(4-methoxyphenyl)sulfonylanilino)acetamide (CID 1100054) is N-cyclohexyl-2-(N-(4-methoxyphenyl)sulfonylanilino)acetamide.
What is the SMILES notation for N-cyclohexyl-2-(N-(4-methoxyphenyl)sulfonylanilino)acetamide?
The canonical SMILES for N-cyclohexyl-2-(N-(4-methoxyphenyl)sulfonylanilino)acetamide is COc1ccc(S(=O)(=O)N(CC(=O)NC2CCCCC2)c2ccccc2)cc1.
What is the InChIKey of N-cyclohexyl-2-(N-(4-methoxyphenyl)sulfonylanilino)acetamide?
The InChIKey is XCMBXHWYMKOBIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H26N2O4S/c1-27-19-12-14-20(15-13-19)28(25,26)23(18-10-6-3-7-11-18)16-21(24)22-17-8-4-2-5-9-17/h3,6-7,10-15,17H,2,4-5,8-9,16H2,1H3,(H,22,24).
What are the key properties of N-cyclohexyl-2-(N-(4-methoxyphenyl)sulfonylanilino)acetamide?
N-cyclohexyl-2-(N-(4-methoxyphenyl)sulfonylanilino)acetamide has a molecular weight of 402.52 g/mol, XLogP of 3.34, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-2-(N-(4-methoxyphenyl)sulfonylanilino)acetamide is sourced from PubChem (CID 1100054), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).