N-methyl-N-propyl-2-(propylamino)pyridine-3-sulfonamide

C12H21N3O2S — CID 62144977

IUPACN-methyl-N-propyl-2-(propylamino)pyridine-3-sulfonamide
SMILESCCCNc1ncccc1S(=O)(=O)N(C)CCC
InChIInChI=1S/C12H21N3O2S/c1-4-8-13-12-11(7-6-9-14-12)18(16,17)15(3)10-5-2/h6-7,9H,4-5,8,10H2,1-3H3,(H,13,14)
InChIKeyZRTGVNUJXYAARD-UHFFFAOYSA-N
MW271.39 g/mol
LogP1.93
Rot. Bonds7

About N-methyl-N-propyl-2-(propylamino)pyridine-3-sulfonamide

N-methyl-N-propyl-2-(propylamino)pyridine-3-sulfonamide (PubChem CID 62144977) has the molecular formula C12H21N3O2S and a molecular weight of 271.39 g/mol. Its IUPAC name is N-methyl-N-propyl-2-(propylamino)pyridine-3-sulfonamide.

Molecular Properties

Compound NameN-methyl-N-propyl-2-(propylamino)pyridine-3-sulfonamide
PubChem CID62144977
Molecular FormulaC12H21N3O2S
Molecular Weight271.39 g/mol
Exact Mass271.14
IUPAC NameN-methyl-N-propyl-2-(propylamino)pyridine-3-sulfonamide
SMILESCCCNc1ncccc1S(=O)(=O)N(C)CCC
InChIInChI=1S/C12H21N3O2S/c1-4-8-13-12-11(7-6-9-14-12)18(16,17)15(3)10-5-2/h6-7,9H,4-5,8,10H2,1-3H3,(H,13,14)
InChIKeyZRTGVNUJXYAARD-UHFFFAOYSA-N
XLogP1.93
TPSA62.30 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.39
LogP ≤ 51.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(cyclopropylmethyl)-N-methyl-2-(propylamino)pyridine-3-sulfonamide
CID 62146200
N-cyclopropyl-N-propyl-2-(propylamino)pyridine-3-sulfonamide
CID 62144651
N-methyl-N-(4-methylpentan-2-yl)-2-(propylamino)pyridine-3-sulfonamide
CID 62152933
N-methyl-2-(propylamino)-N-(thiophen-3-ylmethyl)pyridine-3-sulfonamide
CID 62146077
N-butyl-N-methyl-2-(methylamino)pyridine-3-sulfonamide
CID 62162650
N-cyclopropyl-N-ethyl-2-(propylamino)pyridine-3-sulfonamide
CID 55043917
N-[3-(dimethylamino)propyl]-2-hydrazinyl-N-methylpyridine-3-sulfonamide
CID 63700254
N'-(3-methylsulfonyl-2-pyridinyl)-N-propylethane-1,2-diamine
CID 114599239
N-[2-(dimethylamino)ethyl]-N-methyl-2-(propylamino)benzenesulfonamide
CID 63726361
N-(3-chloro-2-pyridinyl)-2-(propylamino)pyridine-3-sulfonamide
CID 103094788
1-N,5-N-dimethyl-1-N,5-N-dipropylnaphthalene-1,5-disulfonamide
CID 54492944
N-(2,2-difluoroethyl)-2-(propylamino)pyridine-3-sulfonamide
CID 113304047

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-propyl-2-(propylamino)pyridine-3-sulfonamide?
The IUPAC name of N-methyl-N-propyl-2-(propylamino)pyridine-3-sulfonamide (CID 62144977) is N-methyl-N-propyl-2-(propylamino)pyridine-3-sulfonamide.
What is the SMILES notation for N-methyl-N-propyl-2-(propylamino)pyridine-3-sulfonamide?
The canonical SMILES for N-methyl-N-propyl-2-(propylamino)pyridine-3-sulfonamide is CCCNc1ncccc1S(=O)(=O)N(C)CCC.
What is the InChIKey of N-methyl-N-propyl-2-(propylamino)pyridine-3-sulfonamide?
The InChIKey is ZRTGVNUJXYAARD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N3O2S/c1-4-8-13-12-11(7-6-9-14-12)18(16,17)15(3)10-5-2/h6-7,9H,4-5,8,10H2,1-3H3,(H,13,14).
What are the key properties of N-methyl-N-propyl-2-(propylamino)pyridine-3-sulfonamide?
N-methyl-N-propyl-2-(propylamino)pyridine-3-sulfonamide has a molecular weight of 271.39 g/mol, XLogP of 1.93, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-propyl-2-(propylamino)pyridine-3-sulfonamide is sourced from PubChem (CID 62144977), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).