N-(1-methoxypentan-2-yl)-3-(propylamino)pyridine-2-sulfonamide

C14H25N3O3S — CID 103306201

IUPACN-(1-methoxypentan-2-yl)-3-(propylamino)pyridine-2-sulfonamide
SMILESCCCNc1cccnc1S(=O)(=O)NC(CCC)COC
InChIInChI=1S/C14H25N3O3S/c1-4-7-12(11-20-3)17-21(18,19)14-13(15-9-5-2)8-6-10-16-14/h6,8,10,12,15,17H,4-5,7,9,11H2,1-3H3
InChIKeyFCDSMWXKESQOSV-UHFFFAOYSA-N
MW315.44 g/mol
LogP2.00
Rot. Bonds10

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

N-(1-methoxypentan-2-yl)-3-(propylamino)pyridine-2-sulfonamide (PubChem CID 103306201) has the molecular formula C14H25N3O3S and a molecular weight of 315.44 g/mol. Its IUPAC name is N-(1-methoxypentan-2-yl)-3-(propylamino)pyridine-2-sulfonamide.

Molecular Properties

Compound NameN-(1-methoxypentan-2-yl)-3-(propylamino)pyridine-2-sulfonamide
PubChem CID103306201
Molecular FormulaC14H25N3O3S
Molecular Weight315.44 g/mol
Exact Mass315.16
IUPAC NameN-(1-methoxypentan-2-yl)-3-(propylamino)pyridine-2-sulfonamide
SMILESCCCNc1cccnc1S(=O)(=O)NC(CCC)COC
InChIInChI=1S/C14H25N3O3S/c1-4-7-12(11-20-3)17-21(18,19)14-13(15-9-5-2)8-6-10-16-14/h6,8,10,12,15,17H,4-5,7,9,11H2,1-3H3
InChIKeyFCDSMWXKESQOSV-UHFFFAOYSA-N
XLogP2.00
TPSA80.32 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds10
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.44
LogP ≤ 52.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(1-methylsulfanylbutan-2-yl)-3-(propylamino)pyridine-2-sulfonamide
CID 103307489
3-hydrazinyl-N-(1-methoxybutan-2-yl)pyridine-2-sulfonamide
CID 103301625
N-(4-methylpentan-2-yl)-3-(propylamino)pyridine-2-sulfonamide
CID 103304534
N-ethyl-N-(1-methoxypropan-2-yl)-3-(propylamino)pyridine-2-sulfonamide
CID 103305051
N-methyl-3-(propylamino)pyridine-2-sulfonamide
CID 103303712
3-(propylamino)-N-pyrimidin-2-ylpyridine-2-sulfonamide
CID 103303452
N-ethyl-3-(propylamino)pyridine-2-sulfonamide
CID 103303728
N-(4-ethylsulfanylbutan-2-yl)-3-(propylamino)pyridine-2-sulfonamide
CID 103307693
3-[[3-(propylamino)-2-pyridinyl]sulfonylamino]butanamide
CID 103307516
N-(1-cyclobutylethyl)-3-(propylamino)pyridine-2-sulfonamide
CID 103307553
N-(2,2-difluoroethyl)-3-(propylamino)pyridine-2-sulfonamide
CID 103306685
N-(3-ethylpentan-3-yl)-3-(propylamino)pyridine-2-sulfonamide
CID 103306299

Frequently Asked Questions

What is the IUPAC name of N-(1-methoxypentan-2-yl)-3-(propylamino)pyridine-2-sulfonamide?
The IUPAC name of N-(1-methoxypentan-2-yl)-3-(propylamino)pyridine-2-sulfonamide (CID 103306201) is N-(1-methoxypentan-2-yl)-3-(propylamino)pyridine-2-sulfonamide.
What is the SMILES notation for N-(1-methoxypentan-2-yl)-3-(propylamino)pyridine-2-sulfonamide?
The canonical SMILES for N-(1-methoxypentan-2-yl)-3-(propylamino)pyridine-2-sulfonamide is CCCNc1cccnc1S(=O)(=O)NC(CCC)COC.
What is the InChIKey of N-(1-methoxypentan-2-yl)-3-(propylamino)pyridine-2-sulfonamide?
The InChIKey is FCDSMWXKESQOSV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N3O3S/c1-4-7-12(11-20-3)17-21(18,19)14-13(15-9-5-2)8-6-10-16-14/h6,8,10,12,15,17H,4-5,7,9,11H2,1-3H3.
What are the key properties of N-(1-methoxypentan-2-yl)-3-(propylamino)pyridine-2-sulfonamide?
N-(1-methoxypentan-2-yl)-3-(propylamino)pyridine-2-sulfonamide has a molecular weight of 315.44 g/mol, XLogP of 2.00, 10 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-methoxypentan-2-yl)-3-(propylamino)pyridine-2-sulfonamide is sourced from PubChem (CID 103306201), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).