N-methyl-5-[3-(methylamino)piperidine-1-carbonyl]furan-2-sulfonamide

C12H19N3O4S — CID 119493697

IUPACN-methyl-5-[3-(methylamino)piperidine-1-carbonyl]furan-2-sulfonamide
SMILESCNC1CCCN(C(=O)c2ccc(S(=O)(=O)NC)o2)C1
InChIInChI=1S/C12H19N3O4S/c1-13-9-4-3-7-15(8-9)12(16)10-5-6-11(19-10)20(17,18)14-2/h5-6,9,13-14H,3-4,7-8H2,1-2H3
InChIKeyKHFYNIIUJZJFRN-UHFFFAOYSA-N
MW301.37 g/mol
LogP0.01
Rot. Bonds4

About N-methyl-5-[3-(methylamino)piperidine-1-carbonyl]furan-2-sulfonamide

N-methyl-5-[3-(methylamino)piperidine-1-carbonyl]furan-2-sulfonamide (PubChem CID 119493697) has the molecular formula C12H19N3O4S and a molecular weight of 301.37 g/mol. Its IUPAC name is N-methyl-5-[3-(methylamino)piperidine-1-carbonyl]furan-2-sulfonamide.

Molecular Properties

Compound NameN-methyl-5-[3-(methylamino)piperidine-1-carbonyl]furan-2-sulfonamide
PubChem CID119493697
Molecular FormulaC12H19N3O4S
Molecular Weight301.37 g/mol
Exact Mass301.11
IUPAC NameN-methyl-5-[3-(methylamino)piperidine-1-carbonyl]furan-2-sulfonamide
SMILESCNC1CCCN(C(=O)c2ccc(S(=O)(=O)NC)o2)C1
InChIInChI=1S/C12H19N3O4S/c1-13-9-4-3-7-15(8-9)12(16)10-5-6-11(19-10)20(17,18)14-2/h5-6,9,13-14H,3-4,7-8H2,1-2H3
InChIKeyKHFYNIIUJZJFRN-UHFFFAOYSA-N
XLogP0.01
TPSA91.65 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.37
LogP ≤ 50.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze N-methyl-5-[3-(methylamino)piperidine-1-carbonyl]furan-2-sulfonamide 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

5-[3-(hydroxymethyl)piperidine-1-carbonyl]-N-methylfuran-2-sulfonamide
CID 112531799
5-[(3R)-3-[(1S)-1-aminoethyl]piperidine-1-carbonyl]-N-methylfuran-2-sulfonamide
CID 124592409
(5-chlorofuran-2-yl)-[3-(methylamino)piperidin-1-yl]methanone;hydrochloride
CID 119492575
(5-bromofuran-2-yl)-[3-(methylamino)piperidin-1-yl]methanone;hydrochloride
CID 119488242
N-methyl-5-[(2R)-2-methylmorpholine-4-carbonyl]furan-2-sulfonamide
CID 94023334
5-[(2R,6R)-2,6-dimethylmorpholine-4-carbonyl]-N-methylfuran-2-sulfonamide
CID 39878222
1-[5-(methylsulfamoyl)furan-2-carbonyl]piperidine-4-carboxamide
CID 39896620
N-methyl-5-(2-propan-2-ylpyrrolidine-1-carbonyl)furan-2-sulfonamide
CID 47416164
N-methyl-5-(4-oxopiperidine-1-carbonyl)furan-2-sulfonamide
CID 112531251
[3-(methylamino)piperidin-1-yl]-(5-nitrofuran-2-yl)methanone;hydrochloride
CID 119489082
N-methyl-5-[4-(2-methylpropanoyl)piperazine-1-carbonyl]furan-2-sulfonamide
CID 55647946
[5-(methoxymethyl)furan-2-yl]-[3-(methylamino)piperidin-1-yl]methanone;hydrochloride
CID 119488456

Frequently Asked Questions

What is the IUPAC name of N-methyl-5-[3-(methylamino)piperidine-1-carbonyl]furan-2-sulfonamide?
The IUPAC name of N-methyl-5-[3-(methylamino)piperidine-1-carbonyl]furan-2-sulfonamide (CID 119493697) is N-methyl-5-[3-(methylamino)piperidine-1-carbonyl]furan-2-sulfonamide.
What is the SMILES notation for N-methyl-5-[3-(methylamino)piperidine-1-carbonyl]furan-2-sulfonamide?
The canonical SMILES for N-methyl-5-[3-(methylamino)piperidine-1-carbonyl]furan-2-sulfonamide is CNC1CCCN(C(=O)c2ccc(S(=O)(=O)NC)o2)C1.
What is the InChIKey of N-methyl-5-[3-(methylamino)piperidine-1-carbonyl]furan-2-sulfonamide?
The InChIKey is KHFYNIIUJZJFRN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3O4S/c1-13-9-4-3-7-15(8-9)12(16)10-5-6-11(19-10)20(17,18)14-2/h5-6,9,13-14H,3-4,7-8H2,1-2H3.
What are the key properties of N-methyl-5-[3-(methylamino)piperidine-1-carbonyl]furan-2-sulfonamide?
N-methyl-5-[3-(methylamino)piperidine-1-carbonyl]furan-2-sulfonamide has a molecular weight of 301.37 g/mol, XLogP of 0.01, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-5-[3-(methylamino)piperidine-1-carbonyl]furan-2-sulfonamide is sourced from PubChem (CID 119493697), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).