N-(cyclopropylmethyl)-N-ethyl-6-(propylamino)pyridine-3-sulfonamide

C14H23N3O2S — CID 63940107

IUPACN-(cyclopropylmethyl)-N-ethyl-6-(propylamino)pyridine-3-sulfonamide
SMILESCCCNc1ccc(S(=O)(=O)N(CC)CC2CC2)cn1
InChIInChI=1S/C14H23N3O2S/c1-3-9-15-14-8-7-13(10-16-14)20(18,19)17(4-2)11-12-5-6-12/h7-8,10,12H,3-6,9,11H2,1-2H3,(H,15,16)
InChIKeyCMKWZYARVBKTGF-UHFFFAOYSA-N
MW297.42 g/mol
LogP2.32
Rot. Bonds8

About N-(cyclopropylmethyl)-N-ethyl-6-(propylamino)pyridine-3-sulfonamide

N-(cyclopropylmethyl)-N-ethyl-6-(propylamino)pyridine-3-sulfonamide (PubChem CID 63940107) has the molecular formula C14H23N3O2S and a molecular weight of 297.42 g/mol. Its IUPAC name is N-(cyclopropylmethyl)-N-ethyl-6-(propylamino)pyridine-3-sulfonamide.

Molecular Properties

Compound NameN-(cyclopropylmethyl)-N-ethyl-6-(propylamino)pyridine-3-sulfonamide
PubChem CID63940107
Molecular FormulaC14H23N3O2S
Molecular Weight297.42 g/mol
Exact Mass297.15
IUPAC NameN-(cyclopropylmethyl)-N-ethyl-6-(propylamino)pyridine-3-sulfonamide
SMILESCCCNc1ccc(S(=O)(=O)N(CC)CC2CC2)cn1
InChIInChI=1S/C14H23N3O2S/c1-3-9-15-14-8-7-13(10-16-14)20(18,19)17(4-2)11-12-5-6-12/h7-8,10,12H,3-6,9,11H2,1-2H3,(H,15,16)
InChIKeyCMKWZYARVBKTGF-UHFFFAOYSA-N
XLogP2.32
TPSA62.30 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.42
LogP ≤ 52.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-ethyl-N-(2-methylpropyl)-6-(propylamino)pyridine-3-sulfonamide
CID 62143975
N-butyl-N-cyclopropyl-6-(propylamino)pyridine-3-sulfonamide
CID 62156743
6-chloro-N-(cyclobutylmethyl)-N-ethylpyridine-3-sulfonamide
CID 107398335
6-(cyclopropylmethylamino)-N,N-dimethylpyridine-3-sulfonamide
CID 113234561
N-methyl-N-pentan-2-yl-6-(propylamino)pyridine-3-sulfonamide
CID 62147366
N-cyclopropyl-N-(cyclopropylmethyl)-6-(methylamino)pyridine-3-sulfonamide
CID 64523018
N-[3-(dimethylamino)propyl]-N-methyl-6-(propylamino)pyridine-3-sulfonamide
CID 63726875
N-(2-hydroxy-2-methylpropyl)-N-methyl-6-(propylamino)pyridine-3-sulfonamide
CID 79386348
N-(cyclobutylmethyl)-N-ethyl-4-(propylamino)pyridine-3-sulfonamide
CID 107401225
N-(2-methylcyclohexyl)-6-(propylamino)pyridine-3-sulfonamide
CID 62144356
N-(cyclopropylmethyl)-N-ethyl-4-hydrazinylbenzenesulfonamide
CID 63955641
N-(cyclopropylmethyl)-N-propan-2-yl-6-(propylamino)pyridine-3-carboxamide
CID 62178134

Frequently Asked Questions

What is the IUPAC name of N-(cyclopropylmethyl)-N-ethyl-6-(propylamino)pyridine-3-sulfonamide?
The IUPAC name of N-(cyclopropylmethyl)-N-ethyl-6-(propylamino)pyridine-3-sulfonamide (CID 63940107) is N-(cyclopropylmethyl)-N-ethyl-6-(propylamino)pyridine-3-sulfonamide.
What is the SMILES notation for N-(cyclopropylmethyl)-N-ethyl-6-(propylamino)pyridine-3-sulfonamide?
The canonical SMILES for N-(cyclopropylmethyl)-N-ethyl-6-(propylamino)pyridine-3-sulfonamide is CCCNc1ccc(S(=O)(=O)N(CC)CC2CC2)cn1.
What is the InChIKey of N-(cyclopropylmethyl)-N-ethyl-6-(propylamino)pyridine-3-sulfonamide?
The InChIKey is CMKWZYARVBKTGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3O2S/c1-3-9-15-14-8-7-13(10-16-14)20(18,19)17(4-2)11-12-5-6-12/h7-8,10,12H,3-6,9,11H2,1-2H3,(H,15,16).
What are the key properties of N-(cyclopropylmethyl)-N-ethyl-6-(propylamino)pyridine-3-sulfonamide?
N-(cyclopropylmethyl)-N-ethyl-6-(propylamino)pyridine-3-sulfonamide has a molecular weight of 297.42 g/mol, XLogP of 2.32, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclopropylmethyl)-N-ethyl-6-(propylamino)pyridine-3-sulfonamide is sourced from PubChem (CID 63940107), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).