5-[(cyclopropylamino)methyl]-N-(2-methyl-4-pyridinyl)furan-2-sulfonamide

C14H17N3O3S — CID 106071264

IUPAC5-[(cyclopropylamino)methyl]-N-(2-methyl-4-pyridinyl)furan-2-sulfonamide
SMILESCc1cc(NS(=O)(=O)c2ccc(CNC3CC3)o2)ccn1
InChIInChI=1S/C14H17N3O3S/c1-10-8-12(6-7-15-10)17-21(18,19)14-5-4-13(20-14)9-16-11-2-3-11/h4-8,11,16H,2-3,9H2,1H3,(H,15,17)
InChIKeyAKFQDCFXRHRZNV-UHFFFAOYSA-N
MW307.38 g/mol
LogP2.04
Rot. Bonds6

About 5-[(cyclopropylamino)methyl]-N-(2-methyl-4-pyridinyl)furan-2-sulfonamide

5-[(cyclopropylamino)methyl]-N-(2-methyl-4-pyridinyl)furan-2-sulfonamide (PubChem CID 106071264) has the molecular formula C14H17N3O3S and a molecular weight of 307.38 g/mol. Its IUPAC name is 5-[(cyclopropylamino)methyl]-N-(2-methyl-4-pyridinyl)furan-2-sulfonamide.

Molecular Properties

Compound Name5-[(cyclopropylamino)methyl]-N-(2-methyl-4-pyridinyl)furan-2-sulfonamide
PubChem CID106071264
Molecular FormulaC14H17N3O3S
Molecular Weight307.38 g/mol
Exact Mass307.10
IUPAC Name5-[(cyclopropylamino)methyl]-N-(2-methyl-4-pyridinyl)furan-2-sulfonamide
SMILESCc1cc(NS(=O)(=O)c2ccc(CNC3CC3)o2)ccn1
InChIInChI=1S/C14H17N3O3S/c1-10-8-12(6-7-15-10)17-21(18,19)14-5-4-13(20-14)9-16-11-2-3-11/h4-8,11,16H,2-3,9H2,1H3,(H,15,17)
InChIKeyAKFQDCFXRHRZNV-UHFFFAOYSA-N
XLogP2.04
TPSA84.23 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.38
LogP ≤ 52.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

5-[(cyclopropylamino)methyl]-N-(2-methyl-4-pyridinyl)thiophene-2-sulfonamide
CID 106071328
5-[(cyclopropylamino)methyl]-N-(1,3-dimethylpyrazol-4-yl)furan-2-sulfonamide
CID 102807670
N-(1-cyclopentylethyl)-5-[(cyclopropylamino)methyl]furan-2-sulfonamide
CID 106066048
5-[(cyclopropylamino)methyl]-N-[(3-hydroxycyclobutyl)methyl]furan-2-sulfonamide
CID 66007251
N-(cyclopentylsulfamoyl)-2-methylpyridin-4-amine
CID 110675824
5-[(cyclopropylamino)methyl]-N-(5-hydroxypentyl)furan-2-sulfonamide
CID 107323800
5-[(cyclopropylamino)methyl]-N-[(3-hydroxycyclopentyl)methyl]furan-2-sulfonamide
CID 106137735
N-(2-methyl-4-pyridinyl)-4-propylbenzenesulfonamide
CID 110757506
N-[[5-(3-methylbutan-2-ylsulfonylmethyl)furan-2-yl]methyl]cyclopropanamine
CID 107759132
2-chloro-4-methyl-N-(2-methyl-4-pyridinyl)-1,3-thiazole-5-sulfonamide
CID 79240768
5-(ethylaminomethyl)-N-(3-iodophenyl)furan-2-sulfonamide
CID 106029546
2-methyl-N-(2-methyl-4-pyridinyl)benzenesulfonamide
CID 78955887

Frequently Asked Questions

What is the IUPAC name of 5-[(cyclopropylamino)methyl]-N-(2-methyl-4-pyridinyl)furan-2-sulfonamide?
The IUPAC name of 5-[(cyclopropylamino)methyl]-N-(2-methyl-4-pyridinyl)furan-2-sulfonamide (CID 106071264) is 5-[(cyclopropylamino)methyl]-N-(2-methyl-4-pyridinyl)furan-2-sulfonamide.
What is the SMILES notation for 5-[(cyclopropylamino)methyl]-N-(2-methyl-4-pyridinyl)furan-2-sulfonamide?
The canonical SMILES for 5-[(cyclopropylamino)methyl]-N-(2-methyl-4-pyridinyl)furan-2-sulfonamide is Cc1cc(NS(=O)(=O)c2ccc(CNC3CC3)o2)ccn1.
What is the InChIKey of 5-[(cyclopropylamino)methyl]-N-(2-methyl-4-pyridinyl)furan-2-sulfonamide?
The InChIKey is AKFQDCFXRHRZNV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3O3S/c1-10-8-12(6-7-15-10)17-21(18,19)14-5-4-13(20-14)9-16-11-2-3-11/h4-8,11,16H,2-3,9H2,1H3,(H,15,17).
What are the key properties of 5-[(cyclopropylamino)methyl]-N-(2-methyl-4-pyridinyl)furan-2-sulfonamide?
5-[(cyclopropylamino)methyl]-N-(2-methyl-4-pyridinyl)furan-2-sulfonamide has a molecular weight of 307.38 g/mol, XLogP of 2.04, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(cyclopropylamino)methyl]-N-(2-methyl-4-pyridinyl)furan-2-sulfonamide is sourced from PubChem (CID 106071264), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).