N-ethyl-N-(1-methoxypropan-2-yl)-3-(propylamino)pyridine-2-sulfonamide

C14H25N3O3S — CID 103305051

IUPACN-ethyl-N-(1-methoxypropan-2-yl)-3-(propylamino)pyridine-2-sulfonamide
SMILESCCCNc1cccnc1S(=O)(=O)N(CC)C(C)COC
InChIInChI=1S/C14H25N3O3S/c1-5-9-15-13-8-7-10-16-14(13)21(18,19)17(6-2)12(3)11-20-4/h7-8,10,12,15H,5-6,9,11H2,1-4H3
InChIKeyAVVKAQSYGKXDNJ-UHFFFAOYSA-N
MW315.44 g/mol
LogP1.95
Rot. Bonds9

About N-ethyl-N-(1-methoxypropan-2-yl)-3-(propylamino)pyridine-2-sulfonamide

N-ethyl-N-(1-methoxypropan-2-yl)-3-(propylamino)pyridine-2-sulfonamide (PubChem CID 103305051) has the molecular formula C14H25N3O3S and a molecular weight of 315.44 g/mol. Its IUPAC name is N-ethyl-N-(1-methoxypropan-2-yl)-3-(propylamino)pyridine-2-sulfonamide.

Molecular Properties

Compound NameN-ethyl-N-(1-methoxypropan-2-yl)-3-(propylamino)pyridine-2-sulfonamide
PubChem CID103305051
Molecular FormulaC14H25N3O3S
Molecular Weight315.44 g/mol
Exact Mass315.16
IUPAC NameN-ethyl-N-(1-methoxypropan-2-yl)-3-(propylamino)pyridine-2-sulfonamide
SMILESCCCNc1cccnc1S(=O)(=O)N(CC)C(C)COC
InChIInChI=1S/C14H25N3O3S/c1-5-9-15-13-8-7-10-16-14(13)21(18,19)17(6-2)12(3)11-20-4/h7-8,10,12,15H,5-6,9,11H2,1-4H3
InChIKeyAVVKAQSYGKXDNJ-UHFFFAOYSA-N
XLogP1.95
TPSA71.53 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.44
LogP ≤ 51.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N,N-diethyl-3-(propylamino)pyridine-2-sulfonamide
CID 103303638
N-(1-methoxypentan-2-yl)-3-(propylamino)pyridine-2-sulfonamide
CID 103306201
N-methyl-N-(4-methylpentan-2-yl)-3-(propylamino)pyridine-2-sulfonamide
CID 103305537
N-(2,2-difluoroethyl)-N-methyl-3-(propylamino)pyridine-2-sulfonamide
CID 103307540
N-methyl-3-(propylamino)pyridine-2-sulfonamide
CID 103303712
N-(4-methylpentan-2-yl)-3-(propylamino)pyridine-2-sulfonamide
CID 103304534
3-(propylamino)-N-pyrimidin-2-ylpyridine-2-sulfonamide
CID 103303452
N-ethyl-3-(propylamino)pyridine-2-sulfonamide
CID 103303728
N-(3-ethylpentan-3-yl)-3-(propylamino)pyridine-2-sulfonamide
CID 103306299
N-butan-2-yl-N-ethyl-2-(propylamino)benzenesulfonamide
CID 62144303
N-methyl-N-(2-methylsulfanylethyl)-3-(propylamino)pyridine-2-sulfonamide
CID 103306973
N-(2,2-difluoroethyl)-3-(propylamino)pyridine-2-sulfonamide
CID 103306685

Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-(1-methoxypropan-2-yl)-3-(propylamino)pyridine-2-sulfonamide?
The IUPAC name of N-ethyl-N-(1-methoxypropan-2-yl)-3-(propylamino)pyridine-2-sulfonamide (CID 103305051) is N-ethyl-N-(1-methoxypropan-2-yl)-3-(propylamino)pyridine-2-sulfonamide.
What is the SMILES notation for N-ethyl-N-(1-methoxypropan-2-yl)-3-(propylamino)pyridine-2-sulfonamide?
The canonical SMILES for N-ethyl-N-(1-methoxypropan-2-yl)-3-(propylamino)pyridine-2-sulfonamide is CCCNc1cccnc1S(=O)(=O)N(CC)C(C)COC.
What is the InChIKey of N-ethyl-N-(1-methoxypropan-2-yl)-3-(propylamino)pyridine-2-sulfonamide?
The InChIKey is AVVKAQSYGKXDNJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N3O3S/c1-5-9-15-13-8-7-10-16-14(13)21(18,19)17(6-2)12(3)11-20-4/h7-8,10,12,15H,5-6,9,11H2,1-4H3.
What are the key properties of N-ethyl-N-(1-methoxypropan-2-yl)-3-(propylamino)pyridine-2-sulfonamide?
N-ethyl-N-(1-methoxypropan-2-yl)-3-(propylamino)pyridine-2-sulfonamide has a molecular weight of 315.44 g/mol, XLogP of 1.95, 9 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-(1-methoxypropan-2-yl)-3-(propylamino)pyridine-2-sulfonamide is sourced from PubChem (CID 103305051), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).