N-[2-chloro-4-[(5-ethylfuran-2-yl)methylamino]phenyl]methanesulfonamide

C14H17ClN2O3S — CID 62346171

IUPACN-[2-chloro-4-[(5-ethylfuran-2-yl)methylamino]phenyl]methanesulfonamide
SMILESCCc1ccc(CNc2ccc(NS(C)(=O)=O)c(Cl)c2)o1
InChIInChI=1S/C14H17ClN2O3S/c1-3-11-5-6-12(20-11)9-16-10-4-7-14(13(15)8-10)17-21(2,18)19/h4-8,16-17H,3,9H2,1-2H3
InChIKeyZPPUCBSYWYIHPU-UHFFFAOYSA-N
MW328.82 g/mol
LogP3.48
Rot. Bonds6

About N-[2-chloro-4-[(5-ethylfuran-2-yl)methylamino]phenyl]methanesulfonamide

N-[2-chloro-4-[(5-ethylfuran-2-yl)methylamino]phenyl]methanesulfonamide (PubChem CID 62346171) has the molecular formula C14H17ClN2O3S and a molecular weight of 328.82 g/mol. Its IUPAC name is N-[2-chloro-4-[(5-ethylfuran-2-yl)methylamino]phenyl]methanesulfonamide.

Molecular Properties

Compound NameN-[2-chloro-4-[(5-ethylfuran-2-yl)methylamino]phenyl]methanesulfonamide
PubChem CID62346171
Molecular FormulaC14H17ClN2O3S
Molecular Weight328.82 g/mol
Exact Mass328.06
IUPAC NameN-[2-chloro-4-[(5-ethylfuran-2-yl)methylamino]phenyl]methanesulfonamide
SMILESCCc1ccc(CNc2ccc(NS(C)(=O)=O)c(Cl)c2)o1
InChIInChI=1S/C14H17ClN2O3S/c1-3-11-5-6-12(20-11)9-16-10-4-7-14(13(15)8-10)17-21(2,18)19/h4-8,16-17H,3,9H2,1-2H3
InChIKeyZPPUCBSYWYIHPU-UHFFFAOYSA-N
XLogP3.48
TPSA71.34 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.82
LogP ≤ 53.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-[2-chloro-4-[(5-ethylfuran-2-yl)methylamino]phenyl]methanesulfonamide 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

N-[(5-ethylfuran-2-yl)methyl]-4-methyl-3-methylsulfonylaniline
CID 75500026
N-[2-chloro-4-[(2-ethyl-1,3-thiazol-5-yl)methylamino]phenyl]methanesulfonamide
CID 60981950
N-[2-chloro-4-[(2-chlorophenyl)methylamino]phenyl]methanesulfonamide
CID 43744735
N-[2-chloro-4-(thiophen-2-ylmethylamino)phenyl]methanesulfonamide
CID 43744756
N-[2-chloro-4-[(2-ethylpyrazol-3-yl)methylamino]phenyl]methanesulfonamide
CID 115762749
N-[3-chloro-4-(methanesulfonamido)phenyl]methanesulfonamide
CID 5120140
N-[2-chloro-4-[(5-methylfuran-2-yl)methylamino]phenyl]acetamide
CID 43690180
N-[2-chloro-4-[(3-methoxy-3-methylbutyl)amino]phenyl]methanesulfonamide
CID 106675322
2-bromo-N-[3-chloro-4-(methanesulfonamido)phenyl]butanamide
CID 62855661
N-[2-chloro-4-(propan-2-ylamino)phenyl]methanesulfonamide
CID 43744799
tert-butyl N-[3-[3-chloro-4-(methanesulfonamido)anilino]propyl]carbamate
CID 113269164
N-[(5-ethylfuran-2-yl)methyl]-4-propan-2-ylaniline
CID 62345235

Frequently Asked Questions

What is the IUPAC name of N-[2-chloro-4-[(5-ethylfuran-2-yl)methylamino]phenyl]methanesulfonamide?
The IUPAC name of N-[2-chloro-4-[(5-ethylfuran-2-yl)methylamino]phenyl]methanesulfonamide (CID 62346171) is N-[2-chloro-4-[(5-ethylfuran-2-yl)methylamino]phenyl]methanesulfonamide.
What is the SMILES notation for N-[2-chloro-4-[(5-ethylfuran-2-yl)methylamino]phenyl]methanesulfonamide?
The canonical SMILES for N-[2-chloro-4-[(5-ethylfuran-2-yl)methylamino]phenyl]methanesulfonamide is CCc1ccc(CNc2ccc(NS(C)(=O)=O)c(Cl)c2)o1.
What is the InChIKey of N-[2-chloro-4-[(5-ethylfuran-2-yl)methylamino]phenyl]methanesulfonamide?
The InChIKey is ZPPUCBSYWYIHPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17ClN2O3S/c1-3-11-5-6-12(20-11)9-16-10-4-7-14(13(15)8-10)17-21(2,18)19/h4-8,16-17H,3,9H2,1-2H3.
What are the key properties of N-[2-chloro-4-[(5-ethylfuran-2-yl)methylamino]phenyl]methanesulfonamide?
N-[2-chloro-4-[(5-ethylfuran-2-yl)methylamino]phenyl]methanesulfonamide has a molecular weight of 328.82 g/mol, XLogP of 3.48, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-chloro-4-[(5-ethylfuran-2-yl)methylamino]phenyl]methanesulfonamide is sourced from PubChem (CID 62346171), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).