2-amino-5-chloro-N-cyclopropyl-N-(furan-2-ylmethyl)benzenesulfonamide

C14H15ClN2O3S — CID 61112354

IUPAC2-amino-5-chloro-N-cyclopropyl-N-(furan-2-ylmethyl)benzenesulfonamide
SMILESNc1ccc(Cl)cc1S(=O)(=O)N(Cc1ccco1)C1CC1
InChIInChI=1S/C14H15ClN2O3S/c15-10-3-6-13(16)14(8-10)21(18,19)17(11-4-5-11)9-12-2-1-7-20-12/h1-3,6-8,11H,4-5,9,16H2
InChIKeyBKDWCYQQJKAIBC-UHFFFAOYSA-N
MW326.81 g/mol
LogP2.87
Rot. Bonds5

About 2-amino-5-chloro-N-cyclopropyl-N-(furan-2-ylmethyl)benzenesulfonamide

2-amino-5-chloro-N-cyclopropyl-N-(furan-2-ylmethyl)benzenesulfonamide (PubChem CID 61112354) has the molecular formula C14H15ClN2O3S and a molecular weight of 326.81 g/mol. Its IUPAC name is 2-amino-5-chloro-N-cyclopropyl-N-(furan-2-ylmethyl)benzenesulfonamide.

Molecular Properties

Compound Name2-amino-5-chloro-N-cyclopropyl-N-(furan-2-ylmethyl)benzenesulfonamide
PubChem CID61112354
Molecular FormulaC14H15ClN2O3S
Molecular Weight326.81 g/mol
Exact Mass326.05
IUPAC Name2-amino-5-chloro-N-cyclopropyl-N-(furan-2-ylmethyl)benzenesulfonamide
SMILESNc1ccc(Cl)cc1S(=O)(=O)N(Cc1ccco1)C1CC1
InChIInChI=1S/C14H15ClN2O3S/c15-10-3-6-13(16)14(8-10)21(18,19)17(11-4-5-11)9-12-2-1-7-20-12/h1-3,6-8,11H,4-5,9,16H2
InChIKeyBKDWCYQQJKAIBC-UHFFFAOYSA-N
XLogP2.87
TPSA76.54 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.81
LogP ≤ 52.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

Analyze 2-amino-5-chloro-N-cyclopropyl-N-(furan-2-ylmethyl)benzenesulfonamide 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-amino-5-chloro-N-(furan-2-ylmethyl)-N-methylbenzenesulfonamide
CID 54888480
2-amino-N-cyclopropyl-N-(furan-2-ylmethyl)pyridine-3-sulfonamide
CID 65428570
2-amino-5-chloro-N-cyclopropyl-N-(2-methylpropyl)benzenesulfonamide
CID 61111608
5,6-dichloro-N-cyclopropyl-N-(furan-2-ylmethyl)pyridine-3-sulfonamide
CID 64608208
3-amino-4-bromo-N-cyclopropyl-N-(furan-2-ylmethyl)benzenesulfonamide
CID 115328878
2-amino-5-chloro-N-cyclobutyl-N-(2-hydroxyethyl)benzenesulfonamide
CID 102859200
N-cyclopentyl-3,4-difluoro-N-(furan-2-ylmethyl)benzenesulfonamide
CID 87032912
2-[(2-amino-5-chlorophenyl)sulfonyl-cyclopentylamino]acetamide
CID 61108815
1-(4-aminophenyl)-N-cyclopropyl-N-(furan-2-ylmethyl)methanesulfonamide
CID 61111599
N-cyclopentyl-N-(furan-2-ylmethyl)-2-methoxybenzenesulfonamide
CID 71889824
N-cyclopropyl-N-(furan-2-ylmethyl)-4-methyl-2-oxo-3H-1,3-thiazole-5-sulfonamide
CID 60729636
2-amino-N-benzyl-N-cyclopropylbenzenesulfonamide
CID 43576284

Frequently Asked Questions

What is the IUPAC name of 2-amino-5-chloro-N-cyclopropyl-N-(furan-2-ylmethyl)benzenesulfonamide?
The IUPAC name of 2-amino-5-chloro-N-cyclopropyl-N-(furan-2-ylmethyl)benzenesulfonamide (CID 61112354) is 2-amino-5-chloro-N-cyclopropyl-N-(furan-2-ylmethyl)benzenesulfonamide.
What is the SMILES notation for 2-amino-5-chloro-N-cyclopropyl-N-(furan-2-ylmethyl)benzenesulfonamide?
The canonical SMILES for 2-amino-5-chloro-N-cyclopropyl-N-(furan-2-ylmethyl)benzenesulfonamide is Nc1ccc(Cl)cc1S(=O)(=O)N(Cc1ccco1)C1CC1.
What is the InChIKey of 2-amino-5-chloro-N-cyclopropyl-N-(furan-2-ylmethyl)benzenesulfonamide?
The InChIKey is BKDWCYQQJKAIBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15ClN2O3S/c15-10-3-6-13(16)14(8-10)21(18,19)17(11-4-5-11)9-12-2-1-7-20-12/h1-3,6-8,11H,4-5,9,16H2.
What are the key properties of 2-amino-5-chloro-N-cyclopropyl-N-(furan-2-ylmethyl)benzenesulfonamide?
2-amino-5-chloro-N-cyclopropyl-N-(furan-2-ylmethyl)benzenesulfonamide has a molecular weight of 326.81 g/mol, XLogP of 2.87, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-5-chloro-N-cyclopropyl-N-(furan-2-ylmethyl)benzenesulfonamide is sourced from PubChem (CID 61112354), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).