5-(hydroxymethyl)-N-(3-methylcyclopentyl)pyridine-2-sulfonamide

C12H18N2O3S — CID 114551682

IUPAC5-(hydroxymethyl)-N-(3-methylcyclopentyl)pyridine-2-sulfonamide
SMILESCC1CCC(NS(=O)(=O)c2ccc(CO)cn2)C1
InChIInChI=1S/C12H18N2O3S/c1-9-2-4-11(6-9)14-18(16,17)12-5-3-10(8-15)7-13-12/h3,5,7,9,11,14-15H,2,4,6,8H2,1H3
InChIKeyDXZKECRXYNGXGL-UHFFFAOYSA-N
MW270.35 g/mol
LogP1.04
Rot. Bonds4

About 5-(hydroxymethyl)-N-(3-methylcyclopentyl)pyridine-2-sulfonamide

5-(hydroxymethyl)-N-(3-methylcyclopentyl)pyridine-2-sulfonamide (PubChem CID 114551682) has the molecular formula C12H18N2O3S and a molecular weight of 270.35 g/mol. Its IUPAC name is 5-(hydroxymethyl)-N-(3-methylcyclopentyl)pyridine-2-sulfonamide.

Molecular Properties

Compound Name5-(hydroxymethyl)-N-(3-methylcyclopentyl)pyridine-2-sulfonamide
PubChem CID114551682
Molecular FormulaC12H18N2O3S
Molecular Weight270.35 g/mol
Exact Mass270.10
IUPAC Name5-(hydroxymethyl)-N-(3-methylcyclopentyl)pyridine-2-sulfonamide
SMILESCC1CCC(NS(=O)(=O)c2ccc(CO)cn2)C1
InChIInChI=1S/C12H18N2O3S/c1-9-2-4-11(6-9)14-18(16,17)12-5-3-10(8-15)7-13-12/h3,5,7,9,11,14-15H,2,4,6,8H2,1H3
InChIKeyDXZKECRXYNGXGL-UHFFFAOYSA-N
XLogP1.04
TPSA79.29 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.35
LogP ≤ 51.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

5-(aminomethyl)-N-(3-methylcyclopentyl)pyridine-2-sulfonamide
CID 114552024
5-(hydroxymethyl)-N-(4-methylsulfanylcyclohexyl)pyridine-2-sulfonamide
CID 106000954
5-(hydroxymethyl)-N-(2-methyloxolan-3-yl)pyridine-2-sulfonamide
CID 114135348
4-(hydroxymethyl)-N-(3-methylcyclopentyl)thiophene-2-sulfonamide
CID 114551656
N-(2-cyclopropylpropan-2-yl)-5-(hydroxymethyl)pyridine-2-sulfonamide
CID 106001152
N-cyclooctyl-5-(methylaminomethyl)pyridine-2-sulfonamide
CID 106058846
4-(hydroxymethyl)-N-(3-methylcyclohexyl)thiophene-2-sulfonamide
CID 114132125
2-[4-[(3-methylcyclopentyl)sulfamoyl]phenyl]acetic acid
CID 114543628
5-(hydroxymethyl)-N-(3-methylcyclopentyl)thiophene-3-sulfonamide
CID 114551653
[6-[(2S,6R)-2,6-dimethylpiperidin-1-yl]sulfonyl-3-pyridinyl]methanol
CID 104969057
3-(hydroxymethyl)-2-methyl-N-(3-methylcyclopentyl)benzenesulfonamide
CID 114551624
5-(propylaminomethyl)-N-(thian-4-yl)pyridine-2-sulfonamide
CID 106084462

Frequently Asked Questions

What is the IUPAC name of 5-(hydroxymethyl)-N-(3-methylcyclopentyl)pyridine-2-sulfonamide?
The IUPAC name of 5-(hydroxymethyl)-N-(3-methylcyclopentyl)pyridine-2-sulfonamide (CID 114551682) is 5-(hydroxymethyl)-N-(3-methylcyclopentyl)pyridine-2-sulfonamide.
What is the SMILES notation for 5-(hydroxymethyl)-N-(3-methylcyclopentyl)pyridine-2-sulfonamide?
The canonical SMILES for 5-(hydroxymethyl)-N-(3-methylcyclopentyl)pyridine-2-sulfonamide is CC1CCC(NS(=O)(=O)c2ccc(CO)cn2)C1.
What is the InChIKey of 5-(hydroxymethyl)-N-(3-methylcyclopentyl)pyridine-2-sulfonamide?
The InChIKey is DXZKECRXYNGXGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O3S/c1-9-2-4-11(6-9)14-18(16,17)12-5-3-10(8-15)7-13-12/h3,5,7,9,11,14-15H,2,4,6,8H2,1H3.
What are the key properties of 5-(hydroxymethyl)-N-(3-methylcyclopentyl)pyridine-2-sulfonamide?
5-(hydroxymethyl)-N-(3-methylcyclopentyl)pyridine-2-sulfonamide has a molecular weight of 270.35 g/mol, XLogP of 1.04, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(hydroxymethyl)-N-(3-methylcyclopentyl)pyridine-2-sulfonamide is sourced from PubChem (CID 114551682), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).