2-(ethylamino)-N-methyl-N-[(1-methylpyrrolidin-3-yl)methyl]pyridine-4-sulfonamide

C14H24N4O2S — CID 63275008

IUPAC2-(ethylamino)-N-methyl-N-[(1-methylpyrrolidin-3-yl)methyl]pyridine-4-sulfonamide
SMILESCCNc1cc(S(=O)(=O)N(C)CC2CCN(C)C2)ccn1
InChIInChI=1S/C14H24N4O2S/c1-4-15-14-9-13(5-7-16-14)21(19,20)18(3)11-12-6-8-17(2)10-12/h5,7,9,12H,4,6,8,10-11H2,1-3H3,(H,15,16)
InChIKeyNZPJUZOFYAIHFY-UHFFFAOYSA-N
MW312.44 g/mol
LogP1.09
Rot. Bonds6

About 2-(ethylamino)-N-methyl-N-[(1-methylpyrrolidin-3-yl)methyl]pyridine-4-sulfonamide

2-(ethylamino)-N-methyl-N-[(1-methylpyrrolidin-3-yl)methyl]pyridine-4-sulfonamide (PubChem CID 63275008) has the molecular formula C14H24N4O2S and a molecular weight of 312.44 g/mol. Its IUPAC name is 2-(ethylamino)-N-methyl-N-[(1-methylpyrrolidin-3-yl)methyl]pyridine-4-sulfonamide.

Molecular Properties

Compound Name2-(ethylamino)-N-methyl-N-[(1-methylpyrrolidin-3-yl)methyl]pyridine-4-sulfonamide
PubChem CID63275008
Molecular FormulaC14H24N4O2S
Molecular Weight312.44 g/mol
Exact Mass312.16
IUPAC Name2-(ethylamino)-N-methyl-N-[(1-methylpyrrolidin-3-yl)methyl]pyridine-4-sulfonamide
SMILESCCNc1cc(S(=O)(=O)N(C)CC2CCN(C)C2)ccn1
InChIInChI=1S/C14H24N4O2S/c1-4-15-14-9-13(5-7-16-14)21(19,20)18(3)11-12-6-8-17(2)10-12/h5,7,9,12H,4,6,8,10-11H2,1-3H3,(H,15,16)
InChIKeyNZPJUZOFYAIHFY-UHFFFAOYSA-N
XLogP1.09
TPSA65.54 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.44
LogP ≤ 51.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(cyclohexylmethyl)-2-(ethylamino)-N-methylpyridine-4-sulfonamide
CID 62151719
N-methyl-6-(methylamino)-N-[(1-methylpyrrolidin-3-yl)methyl]pyridine-3-sulfonamide
CID 63274885
N-(2,2-dimethylpropyl)-2-(ethylamino)-N-methylpyridine-4-sulfonamide
CID 62151680
N-[(1-methylpyrrolidin-3-yl)methyl]-2-(propylamino)pyridine-4-sulfonamide
CID 62146336
N-(1,3-dimethylpiperidin-4-yl)-2-(ethylamino)pyridine-4-sulfonamide
CID 114505908
N-methyl-3-(methylamino)-N-[(1-methylpyrrolidin-3-yl)methyl]pyridine-2-sulfonamide
CID 103305951
N,N-diethyl-2-(ethylamino)pyridine-4-sulfonamide
CID 62150008
1-[[2-(ethylamino)-4-pyridinyl]sulfonyl]pyrrolidin-3-ol
CID 62942337
4-amino-3-fluoro-N-methyl-N-[(1-methylpyrrolidin-3-yl)methyl]benzenesulfonamide
CID 82843657
3-acetyl-N-methyl-N-[(1-methylpyrrolidin-3-yl)methyl]benzenesulfonamide
CID 63274742
N-methyl-N-[(2-methylcyclopropyl)methyl]-2-(propylamino)pyridine-4-sulfonamide
CID 63859240
4-(3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-ylsulfonyl)-N-ethylpyridin-2-amine
CID 79933811

Frequently Asked Questions

What is the IUPAC name of 2-(ethylamino)-N-methyl-N-[(1-methylpyrrolidin-3-yl)methyl]pyridine-4-sulfonamide?
The IUPAC name of 2-(ethylamino)-N-methyl-N-[(1-methylpyrrolidin-3-yl)methyl]pyridine-4-sulfonamide (CID 63275008) is 2-(ethylamino)-N-methyl-N-[(1-methylpyrrolidin-3-yl)methyl]pyridine-4-sulfonamide.
What is the SMILES notation for 2-(ethylamino)-N-methyl-N-[(1-methylpyrrolidin-3-yl)methyl]pyridine-4-sulfonamide?
The canonical SMILES for 2-(ethylamino)-N-methyl-N-[(1-methylpyrrolidin-3-yl)methyl]pyridine-4-sulfonamide is CCNc1cc(S(=O)(=O)N(C)CC2CCN(C)C2)ccn1.
What is the InChIKey of 2-(ethylamino)-N-methyl-N-[(1-methylpyrrolidin-3-yl)methyl]pyridine-4-sulfonamide?
The InChIKey is NZPJUZOFYAIHFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N4O2S/c1-4-15-14-9-13(5-7-16-14)21(19,20)18(3)11-12-6-8-17(2)10-12/h5,7,9,12H,4,6,8,10-11H2,1-3H3,(H,15,16).
What are the key properties of 2-(ethylamino)-N-methyl-N-[(1-methylpyrrolidin-3-yl)methyl]pyridine-4-sulfonamide?
2-(ethylamino)-N-methyl-N-[(1-methylpyrrolidin-3-yl)methyl]pyridine-4-sulfonamide has a molecular weight of 312.44 g/mol, XLogP of 1.09, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(ethylamino)-N-methyl-N-[(1-methylpyrrolidin-3-yl)methyl]pyridine-4-sulfonamide is sourced from PubChem (CID 63275008), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).