N-(cyclohexylmethyl)-4-methoxy-3-morpholin-4-ylsulfonylbenzamide

C19H28N2O5S — CID 2083235

IUPACN-(cyclohexylmethyl)-4-methoxy-3-morpholin-4-ylsulfonylbenzamide
SMILESCOc1ccc(C(=O)NCC2CCCCC2)cc1S(=O)(=O)N1CCOCC1
InChIInChI=1S/C19H28N2O5S/c1-25-17-8-7-16(19(22)20-14-15-5-3-2-4-6-15)13-18(17)27(23,24)21-9-11-26-12-10-21/h7-8,13,15H,2-6,9-12,14H2,1H3,(H,20,22)
InChIKeyWESYZQZBSFDXQQ-UHFFFAOYSA-N
MW396.51 g/mol
LogP2.03
Rot. Bonds6

About N-(cyclohexylmethyl)-4-methoxy-3-morpholin-4-ylsulfonylbenzamide

N-(cyclohexylmethyl)-4-methoxy-3-morpholin-4-ylsulfonylbenzamide (PubChem CID 2083235) has the molecular formula C19H28N2O5S and a molecular weight of 396.51 g/mol. Its IUPAC name is N-(cyclohexylmethyl)-4-methoxy-3-morpholin-4-ylsulfonylbenzamide.

Molecular Properties

Compound NameN-(cyclohexylmethyl)-4-methoxy-3-morpholin-4-ylsulfonylbenzamide
PubChem CID2083235
Molecular FormulaC19H28N2O5S
Molecular Weight396.51 g/mol
Exact Mass396.17
IUPAC NameN-(cyclohexylmethyl)-4-methoxy-3-morpholin-4-ylsulfonylbenzamide
SMILESCOc1ccc(C(=O)NCC2CCCCC2)cc1S(=O)(=O)N1CCOCC1
InChIInChI=1S/C19H28N2O5S/c1-25-17-8-7-16(19(22)20-14-15-5-3-2-4-6-15)13-18(17)27(23,24)21-9-11-26-12-10-21/h7-8,13,15H,2-6,9-12,14H2,1H3,(H,20,22)
InChIKeyWESYZQZBSFDXQQ-UHFFFAOYSA-N
XLogP2.03
TPSA84.94 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500396.51
LogP ≤ 52.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-Benzenesulfonylamino-3-[4-(2-piperidin-4-yl-ethoxy)-benzoylamino]-propionic acid
CID 9826223
4-fluoro-N'-(4-methoxybenzoyl)-3-morpholin-4-ylsulfonylbenzohydrazide
CID 2528547
N-[2-(dimethylamino)-2-(4-methoxyphenyl)ethyl]-4-(3,5-dimethylpiperidin-1-yl)sulfonylbenzamide
CID 4354484
[2-[2-(4-Fluorophenyl)ethylamino]-2-oxoethyl] 4-methoxy-3-morpholin-4-ylsulfonylbenzoate
CID 4845868
4-(dimethylsulfamoyl)-N-(2-phenoxyethyl)benzamide
CID 2291802
MicroRNA modulator-1
CID 5967303
N-[2-(4-methoxyphenyl)ethyl]-4-[4-(prop-2-enoylamino)piperidin-1-yl]sulfonylbenzamide
CID 71456565
N-[[4-(benzenesulfonamidomethyl)phenyl]methyl]-4-methoxy-benzamide
CID 130431450
4-methoxy-N-[[4-[(p-tolylsulfonylamino)methyl]phenyl]methyl]benzamide
CID 130431472
4-Ethoxy-N-(1-methanesulfonyl-piperidin-4-yl)-benzamide
CID 645933
4-methoxy-3-(4-morpholinylsulfonyl)-N-(2-thienylmethyl)benzamide
CID 1081050
4-Methoxy-3-(morpholin-4-ylsulfonyl)phenyl 4-phenylpiperazinyl ketone
CID 1087791

Frequently Asked Questions

What is the IUPAC name of N-(cyclohexylmethyl)-4-methoxy-3-morpholin-4-ylsulfonylbenzamide?
The IUPAC name of N-(cyclohexylmethyl)-4-methoxy-3-morpholin-4-ylsulfonylbenzamide (CID 2083235) is N-(cyclohexylmethyl)-4-methoxy-3-morpholin-4-ylsulfonylbenzamide.
What is the SMILES notation for N-(cyclohexylmethyl)-4-methoxy-3-morpholin-4-ylsulfonylbenzamide?
The canonical SMILES for N-(cyclohexylmethyl)-4-methoxy-3-morpholin-4-ylsulfonylbenzamide is COc1ccc(C(=O)NCC2CCCCC2)cc1S(=O)(=O)N1CCOCC1.
What is the InChIKey of N-(cyclohexylmethyl)-4-methoxy-3-morpholin-4-ylsulfonylbenzamide?
The InChIKey is WESYZQZBSFDXQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H28N2O5S/c1-25-17-8-7-16(19(22)20-14-15-5-3-2-4-6-15)13-18(17)27(23,24)21-9-11-26-12-10-21/h7-8,13,15H,2-6,9-12,14H2,1H3,(H,20,22).
What are the key properties of N-(cyclohexylmethyl)-4-methoxy-3-morpholin-4-ylsulfonylbenzamide?
N-(cyclohexylmethyl)-4-methoxy-3-morpholin-4-ylsulfonylbenzamide has a molecular weight of 396.51 g/mol, XLogP of 2.03, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclohexylmethyl)-4-methoxy-3-morpholin-4-ylsulfonylbenzamide is sourced from PubChem (CID 2083235), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).