2-[benzenesulfonyl(cyclohexyl)amino]-N-(2,2-dimethylpropyl)acetamide

C19H30N2O3S — CID 100799819

IUPAC2-[benzenesulfonyl(cyclohexyl)amino]-N-(2,2-dimethylpropyl)acetamide
SMILESCC(C)(C)CNC(=O)CN(C1CCCCC1)S(=O)(=O)c1ccccc1
InChIInChI=1S/C19H30N2O3S/c1-19(2,3)15-20-18(22)14-21(16-10-6-4-7-11-16)25(23,24)17-12-8-5-9-13-17/h5,8-9,12-13,16H,4,6-7,10-11,14-15H2,1-3H3,(H,20,22)
InChIKeyNFYUUHADMFKVJY-UHFFFAOYSA-N
MW366.53 g/mol
LogP3.17
Rot. Bonds6

About 2-[benzenesulfonyl(cyclohexyl)amino]-N-(2,2-dimethylpropyl)acetamide

2-[benzenesulfonyl(cyclohexyl)amino]-N-(2,2-dimethylpropyl)acetamide (PubChem CID 100799819) has the molecular formula C19H30N2O3S and a molecular weight of 366.53 g/mol. Its IUPAC name is 2-[benzenesulfonyl(cyclohexyl)amino]-N-(2,2-dimethylpropyl)acetamide.

Molecular Properties

Compound Name2-[benzenesulfonyl(cyclohexyl)amino]-N-(2,2-dimethylpropyl)acetamide
PubChem CID100799819
Molecular FormulaC19H30N2O3S
Molecular Weight366.53 g/mol
Exact Mass366.20
IUPAC Name2-[benzenesulfonyl(cyclohexyl)amino]-N-(2,2-dimethylpropyl)acetamide
SMILESCC(C)(C)CNC(=O)CN(C1CCCCC1)S(=O)(=O)c1ccccc1
InChIInChI=1S/C19H30N2O3S/c1-19(2,3)15-20-18(22)14-21(16-10-6-4-7-11-16)25(23,24)17-12-8-5-9-13-17/h5,8-9,12-13,16H,4,6-7,10-11,14-15H2,1-3H3,(H,20,22)
InChIKeyNFYUUHADMFKVJY-UHFFFAOYSA-N
XLogP3.17
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.53
LogP ≤ 53.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[benzenesulfonyl(cyclohexyl)amino]-N-phenylacetamide
CID 45374457
2-[(3-chloro-4-methoxyphenyl)sulfonyl-cyclohexylamino]-N-(2,2-dimethylpropyl)acetamide
CID 100797119
2-[benzenesulfonyl(cyclohexyl)amino]-N-pentan-2-ylacetamide
CID 21380289
2-[(4-bromophenyl)sulfonyl-cyclohexylamino]-N-ethylacetamide
CID 4207935
2-[cyclohexyl-(4-fluorophenyl)sulfonylamino]-N-(2-phenylethyl)acetamide
CID 2917007
2-[benzenesulfonyl(cyclohexyl)amino]-N-[(1S)-1-(4-chlorophenyl)ethyl]acetamide
CID 28543278
2-[benzenesulfonyl(cyclohexyl)amino]-N-[4-chloro-3-(trifluoromethyl)phenyl]acetamide
CID 1331347
2-[(4-bromophenyl)sulfonyl-cyclohexylamino]-N-methylacetamide
CID 1342586
2-[benzenesulfonyl(cyclohexyl)amino]-N-[2-[(5-phenyl-1H-1,2,4-triazol-3-yl)sulfanyl]ethyl]acetamide
CID 100789838
2-[benzenesulfonyl(cyclohexyl)amino]-N-[2-chloro-5-(trifluoromethyl)phenyl]acetamide
CID 25249574
2-[cyclohexyl-(4-fluorophenyl)sulfonylamino]-N-[(1S)-1-phenylethyl]acetamide
CID 40554659
methyl 2-[[2-[benzenesulfonyl(cyclohexyl)amino]acetyl]amino]-4,5-dimethoxybenzoate
CID 45372813

Frequently Asked Questions

What is the IUPAC name of 2-[benzenesulfonyl(cyclohexyl)amino]-N-(2,2-dimethylpropyl)acetamide?
The IUPAC name of 2-[benzenesulfonyl(cyclohexyl)amino]-N-(2,2-dimethylpropyl)acetamide (CID 100799819) is 2-[benzenesulfonyl(cyclohexyl)amino]-N-(2,2-dimethylpropyl)acetamide.
What is the SMILES notation for 2-[benzenesulfonyl(cyclohexyl)amino]-N-(2,2-dimethylpropyl)acetamide?
The canonical SMILES for 2-[benzenesulfonyl(cyclohexyl)amino]-N-(2,2-dimethylpropyl)acetamide is CC(C)(C)CNC(=O)CN(C1CCCCC1)S(=O)(=O)c1ccccc1.
What is the InChIKey of 2-[benzenesulfonyl(cyclohexyl)amino]-N-(2,2-dimethylpropyl)acetamide?
The InChIKey is NFYUUHADMFKVJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H30N2O3S/c1-19(2,3)15-20-18(22)14-21(16-10-6-4-7-11-16)25(23,24)17-12-8-5-9-13-17/h5,8-9,12-13,16H,4,6-7,10-11,14-15H2,1-3H3,(H,20,22).
What are the key properties of 2-[benzenesulfonyl(cyclohexyl)amino]-N-(2,2-dimethylpropyl)acetamide?
2-[benzenesulfonyl(cyclohexyl)amino]-N-(2,2-dimethylpropyl)acetamide has a molecular weight of 366.53 g/mol, XLogP of 3.17, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[benzenesulfonyl(cyclohexyl)amino]-N-(2,2-dimethylpropyl)acetamide is sourced from PubChem (CID 100799819), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).