3-(cyclopentylsulfamoyl)-N-cyclopropyl-N-[1-(furan-2-yl)ethyl]-4-methoxybenzamide

C22H28N2O5S — CID 60576610

IUPAC3-(cyclopentylsulfamoyl)-N-cyclopropyl-N-[1-(furan-2-yl)ethyl]-4-methoxybenzamide
SMILESCOc1ccc(C(=O)N(C2CC2)C(C)c2ccco2)cc1S(=O)(=O)NC1CCCC1
InChIInChI=1S/C22H28N2O5S/c1-15(19-8-5-13-29-19)24(18-10-11-18)22(25)16-9-12-20(28-2)21(14-16)30(26,27)23-17-6-3-4-7-17/h5,8-9,12-15,17-18,23H,3-4,6-7,10-11H2,1-2H3
InChIKeyWFAQXYAIOMRIDH-UHFFFAOYSA-N
MW432.54 g/mol
LogP3.87
Rot. Bonds8

About 3-(cyclopentylsulfamoyl)-N-cyclopropyl-N-[1-(furan-2-yl)ethyl]-4-methoxybenzamide

3-(cyclopentylsulfamoyl)-N-cyclopropyl-N-[1-(furan-2-yl)ethyl]-4-methoxybenzamide (PubChem CID 60576610) has the molecular formula C22H28N2O5S and a molecular weight of 432.54 g/mol. Its IUPAC name is 3-(cyclopentylsulfamoyl)-N-cyclopropyl-N-[1-(furan-2-yl)ethyl]-4-methoxybenzamide.

Molecular Properties

Compound Name3-(cyclopentylsulfamoyl)-N-cyclopropyl-N-[1-(furan-2-yl)ethyl]-4-methoxybenzamide
PubChem CID60576610
Molecular FormulaC22H28N2O5S
Molecular Weight432.54 g/mol
Exact Mass432.17
IUPAC Name3-(cyclopentylsulfamoyl)-N-cyclopropyl-N-[1-(furan-2-yl)ethyl]-4-methoxybenzamide
SMILESCOc1ccc(C(=O)N(C2CC2)C(C)c2ccco2)cc1S(=O)(=O)NC1CCCC1
InChIInChI=1S/C22H28N2O5S/c1-15(19-8-5-13-29-19)24(18-10-11-18)22(25)16-9-12-20(28-2)21(14-16)30(26,27)23-17-6-3-4-7-17/h5,8-9,12-15,17-18,23H,3-4,6-7,10-11H2,1-2H3
InChIKeyWFAQXYAIOMRIDH-UHFFFAOYSA-N
XLogP3.87
TPSA88.85 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500432.54
LogP ≤ 53.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-(cyclopropylsulfamoyl)-N-[(1R)-1-(furan-2-yl)ethyl]-4-methoxybenzamide
CID 9453559
N-cyclopropyl-N-[1-(furan-2-yl)ethyl]-4-methoxy-3-nitrobenzamide
CID 60576427
[1-(dimethylamino)-1-oxopropan-2-yl] 3-(cyclopentylsulfamoyl)-4-methoxybenzoate
CID 55392531
3-(cyclobutylsulfamoyl)-4-methoxybenzoic acid
CID 55067218
3-(cyclopentylsulfamoyl)-4-methoxy-N-methyl-N-[(4-propan-2-ylphenyl)methyl]benzamide
CID 27833083
N-[(1R)-1-(1,3-benzothiazol-2-yl)ethyl]-3-(cyclopentylsulfamoyl)-4-methoxy-N-methylbenzamide
CID 25382824
N-cyclopentyl-2-methoxy-5-(piperidine-1-carbonyl)benzenesulfonamide
CID 4060589
3-(cyclopentylsulfamoyl)-N-[2,6-di(propan-2-yl)phenyl]-4-methoxybenzamide
CID 26102322
3-(cyclopentylsulfamoyl)-4-methoxy-N-methyl-N-(2-phenoxyethyl)benzamide
CID 27822020
5-(3,4,4a,5,6,7,8,8a-octahydro-2H-quinoline-1-carbonyl)-N-cyclopropyl-2-methoxybenzenesulfonamide
CID 17439024
3-(cyclopentylsulfamoyl)-4-methoxy-N-methyl-N-[(5-methylfuran-2-yl)methyl]benzamide
CID 27780589
N-cyclopentyl-2-methoxy-5-(2-propan-2-yliminopyridine-1-carbonyl)benzenesulfonamide
CID 55505510

Frequently Asked Questions

What is the IUPAC name of 3-(cyclopentylsulfamoyl)-N-cyclopropyl-N-[1-(furan-2-yl)ethyl]-4-methoxybenzamide?
The IUPAC name of 3-(cyclopentylsulfamoyl)-N-cyclopropyl-N-[1-(furan-2-yl)ethyl]-4-methoxybenzamide (CID 60576610) is 3-(cyclopentylsulfamoyl)-N-cyclopropyl-N-[1-(furan-2-yl)ethyl]-4-methoxybenzamide.
What is the SMILES notation for 3-(cyclopentylsulfamoyl)-N-cyclopropyl-N-[1-(furan-2-yl)ethyl]-4-methoxybenzamide?
The canonical SMILES for 3-(cyclopentylsulfamoyl)-N-cyclopropyl-N-[1-(furan-2-yl)ethyl]-4-methoxybenzamide is COc1ccc(C(=O)N(C2CC2)C(C)c2ccco2)cc1S(=O)(=O)NC1CCCC1.
What is the InChIKey of 3-(cyclopentylsulfamoyl)-N-cyclopropyl-N-[1-(furan-2-yl)ethyl]-4-methoxybenzamide?
The InChIKey is WFAQXYAIOMRIDH-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H28N2O5S/c1-15(19-8-5-13-29-19)24(18-10-11-18)22(25)16-9-12-20(28-2)21(14-16)30(26,27)23-17-6-3-4-7-17/h5,8-9,12-15,17-18,23H,3-4,6-7,10-11H2,1-2H3.
What are the key properties of 3-(cyclopentylsulfamoyl)-N-cyclopropyl-N-[1-(furan-2-yl)ethyl]-4-methoxybenzamide?
3-(cyclopentylsulfamoyl)-N-cyclopropyl-N-[1-(furan-2-yl)ethyl]-4-methoxybenzamide has a molecular weight of 432.54 g/mol, XLogP of 3.87, 8 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(cyclopentylsulfamoyl)-N-cyclopropyl-N-[1-(furan-2-yl)ethyl]-4-methoxybenzamide is sourced from PubChem (CID 60576610), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).