2-(ethylamino)-N-[(1-methylcyclopentyl)methyl]pyridine-4-sulfonamide

C14H23N3O2S — CID 63830358

IUPAC2-(ethylamino)-N-[(1-methylcyclopentyl)methyl]pyridine-4-sulfonamide
SMILESCCNc1cc(S(=O)(=O)NCC2(C)CCCC2)ccn1
InChIInChI=1S/C14H23N3O2S/c1-3-15-13-10-12(6-9-16-13)20(18,19)17-11-14(2)7-4-5-8-14/h6,9-10,17H,3-5,7-8,11H2,1-2H3,(H,15,16)
InChIKeyRXJSICHJFFCMQO-UHFFFAOYSA-N
MW297.42 g/mol
LogP2.37
Rot. Bonds6

About 2-(ethylamino)-N-[(1-methylcyclopentyl)methyl]pyridine-4-sulfonamide

2-(ethylamino)-N-[(1-methylcyclopentyl)methyl]pyridine-4-sulfonamide (PubChem CID 63830358) has the molecular formula C14H23N3O2S and a molecular weight of 297.42 g/mol. Its IUPAC name is 2-(ethylamino)-N-[(1-methylcyclopentyl)methyl]pyridine-4-sulfonamide.

Molecular Properties

Compound Name2-(ethylamino)-N-[(1-methylcyclopentyl)methyl]pyridine-4-sulfonamide
PubChem CID63830358
Molecular FormulaC14H23N3O2S
Molecular Weight297.42 g/mol
Exact Mass297.15
IUPAC Name2-(ethylamino)-N-[(1-methylcyclopentyl)methyl]pyridine-4-sulfonamide
SMILESCCNc1cc(S(=O)(=O)NCC2(C)CCCC2)ccn1
InChIInChI=1S/C14H23N3O2S/c1-3-15-13-10-12(6-9-16-13)20(18,19)17-11-14(2)7-4-5-8-14/h6,9-10,17H,3-5,7-8,11H2,1-2H3,(H,15,16)
InChIKeyRXJSICHJFFCMQO-UHFFFAOYSA-N
XLogP2.37
TPSA71.09 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.42
LogP ≤ 52.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(ethylamino)-N-[(1-methylcyclopentyl)methyl]pyridine-4-sulfonamide?
The IUPAC name of 2-(ethylamino)-N-[(1-methylcyclopentyl)methyl]pyridine-4-sulfonamide (CID 63830358) is 2-(ethylamino)-N-[(1-methylcyclopentyl)methyl]pyridine-4-sulfonamide.
What is the SMILES notation for 2-(ethylamino)-N-[(1-methylcyclopentyl)methyl]pyridine-4-sulfonamide?
The canonical SMILES for 2-(ethylamino)-N-[(1-methylcyclopentyl)methyl]pyridine-4-sulfonamide is CCNc1cc(S(=O)(=O)NCC2(C)CCCC2)ccn1.
What is the InChIKey of 2-(ethylamino)-N-[(1-methylcyclopentyl)methyl]pyridine-4-sulfonamide?
The InChIKey is RXJSICHJFFCMQO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3O2S/c1-3-15-13-10-12(6-9-16-13)20(18,19)17-11-14(2)7-4-5-8-14/h6,9-10,17H,3-5,7-8,11H2,1-2H3,(H,15,16).
What are the key properties of 2-(ethylamino)-N-[(1-methylcyclopentyl)methyl]pyridine-4-sulfonamide?
2-(ethylamino)-N-[(1-methylcyclopentyl)methyl]pyridine-4-sulfonamide has a molecular weight of 297.42 g/mol, XLogP of 2.37, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(ethylamino)-N-[(1-methylcyclopentyl)methyl]pyridine-4-sulfonamide is sourced from PubChem (CID 63830358), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).