2-[[2-(benzenesulfonamido)acetyl]-(furan-2-ylmethyl)amino]-N-cyclohexylpentanamide

C24H33N3O5S — CID 646714

IUPAC2-[[2-(benzenesulfonamido)acetyl]-(furan-2-ylmethyl)amino]-N-cyclohexylpentanamide
SMILESCCCC(C(=O)NC1CCCCC1)N(Cc1ccco1)C(=O)CNS(=O)(=O)c1ccccc1
InChIInChI=1S/C24H33N3O5S/c1-2-10-22(24(29)26-19-11-5-3-6-12-19)27(18-20-13-9-16-32-20)23(28)17-25-33(30,31)21-14-7-4-8-15-21/h4,7-9,13-16,19,22,25H,2-3,5-6,10-12,17-18H2,1H3,(H,26,29)
InChIKeyBENQASPECLGWTR-UHFFFAOYSA-N
MW475.61 g/mol
LogP3.20
Rot. Bonds11

About 2-[[2-(benzenesulfonamido)acetyl]-(furan-2-ylmethyl)amino]-N-cyclohexylpentanamide

2-[[2-(benzenesulfonamido)acetyl]-(furan-2-ylmethyl)amino]-N-cyclohexylpentanamide (PubChem CID 646714) has the molecular formula C24H33N3O5S and a molecular weight of 475.61 g/mol. Its IUPAC name is 2-[[2-(benzenesulfonamido)acetyl]-(furan-2-ylmethyl)amino]-N-cyclohexylpentanamide.

Molecular Properties

Compound Name2-[[2-(benzenesulfonamido)acetyl]-(furan-2-ylmethyl)amino]-N-cyclohexylpentanamide
PubChem CID646714
Molecular FormulaC24H33N3O5S
Molecular Weight475.61 g/mol
Exact Mass475.21
IUPAC Name2-[[2-(benzenesulfonamido)acetyl]-(furan-2-ylmethyl)amino]-N-cyclohexylpentanamide
SMILESCCCC(C(=O)NC1CCCCC1)N(Cc1ccco1)C(=O)CNS(=O)(=O)c1ccccc1
InChIInChI=1S/C24H33N3O5S/c1-2-10-22(24(29)26-19-11-5-3-6-12-19)27(18-20-13-9-16-32-20)23(28)17-25-33(30,31)21-14-7-4-8-15-21/h4,7-9,13-16,19,22,25H,2-3,5-6,10-12,17-18H2,1H3,(H,26,29)
InChIKeyBENQASPECLGWTR-UHFFFAOYSA-N
XLogP3.20
TPSA108.72 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds11
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500475.61
LogP ≤ 53.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 2-[[2-(benzenesulfonamido)acetyl]-(furan-2-ylmethyl)amino]-N-cyclohexylpentanamide 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

(4-Benzenesulfonyl-piperazin-1-yl)-furan-2-yl-methanone
CID 719657
N~2~-(3-aminopropyl)-N-[(furan-2-yl)methyl]-N~2~-(2-phenylethyl)-N-[2-(4-sulfamoylphenyl)ethyl]glycinamide
CID 146171280
2-(4-Fluoro-benzenesulfonylamino)-N-furan-2-ylmethyl-N-(phenethylcarbamoyl-methyl)-acetamide
CID 653223
1-[(N-acetylglycyl)(2-furylmethyl)amino]-N-cyclohexylcyclohexanecarboxamide
CID 3240475
4-Dipropylsulfamoyl-N-furan-2-ylmethyl-benzamide
CID 1128083
3-[[(3,4-dimethoxyphenyl)sulfonyl](2-furylmethyl)amino]-N-methylpropanamide
CID 2822846
3-(benzenesulfonamido)-N-methyl-N-[(5-methylfuran-2-yl)methyl]propanamide
CID 4807529
2-[Ethyl-(4-methoxy-benzenesulfonyl)-amino]-N-furan-2-ylmethyl-acetamide
CID 6493385
N-Furan-2-ylmethyl-4-(4-methyl-piperidine-1-sulfonyl)-benzamide
CID 1044182
N-(2-furylmethyl)-1-(2-naphthylsulfonyl)prolinamide
CID 2921998
N-Furan-2-ylmethyl-4-[(tetrahydro-furan-2-ylmethyl)-sulfamoyl]-benzamide
CID 645494
N-(2-furylmethyl)-4-({[(4-methylphenyl)sulfonyl]amino}methyl)cyclohexanecarboxamide
CID 3239602

Frequently Asked Questions

What is the IUPAC name of 2-[[2-(benzenesulfonamido)acetyl]-(furan-2-ylmethyl)amino]-N-cyclohexylpentanamide?
The IUPAC name of 2-[[2-(benzenesulfonamido)acetyl]-(furan-2-ylmethyl)amino]-N-cyclohexylpentanamide (CID 646714) is 2-[[2-(benzenesulfonamido)acetyl]-(furan-2-ylmethyl)amino]-N-cyclohexylpentanamide.
What is the SMILES notation for 2-[[2-(benzenesulfonamido)acetyl]-(furan-2-ylmethyl)amino]-N-cyclohexylpentanamide?
The canonical SMILES for 2-[[2-(benzenesulfonamido)acetyl]-(furan-2-ylmethyl)amino]-N-cyclohexylpentanamide is CCCC(C(=O)NC1CCCCC1)N(Cc1ccco1)C(=O)CNS(=O)(=O)c1ccccc1.
What is the InChIKey of 2-[[2-(benzenesulfonamido)acetyl]-(furan-2-ylmethyl)amino]-N-cyclohexylpentanamide?
The InChIKey is BENQASPECLGWTR-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H33N3O5S/c1-2-10-22(24(29)26-19-11-5-3-6-12-19)27(18-20-13-9-16-32-20)23(28)17-25-33(30,31)21-14-7-4-8-15-21/h4,7-9,13-16,19,22,25H,2-3,5-6,10-12,17-18H2,1H3,(H,26,29).
What are the key properties of 2-[[2-(benzenesulfonamido)acetyl]-(furan-2-ylmethyl)amino]-N-cyclohexylpentanamide?
2-[[2-(benzenesulfonamido)acetyl]-(furan-2-ylmethyl)amino]-N-cyclohexylpentanamide has a molecular weight of 475.61 g/mol, XLogP of 3.20, 11 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[2-(benzenesulfonamido)acetyl]-(furan-2-ylmethyl)amino]-N-cyclohexylpentanamide is sourced from PubChem (CID 646714), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).