N-(2-amino-1-cyclopentylethyl)-5-chloropyridine-3-sulfonamide

C12H18ClN3O2S — CID 120584957

IUPACN-(2-amino-1-cyclopentylethyl)-5-chloropyridine-3-sulfonamide
SMILESNCC(NS(=O)(=O)c1cncc(Cl)c1)C1CCCC1
InChIInChI=1S/C12H18ClN3O2S/c13-10-5-11(8-15-7-10)19(17,18)16-12(6-14)9-3-1-2-4-9/h5,7-9,12,16H,1-4,6,14H2
InChIKeyHNIQGRXRVBMDER-UHFFFAOYSA-N
MW303.81 g/mol
LogP1.53
Rot. Bonds5

About N-(2-amino-1-cyclopentylethyl)-5-chloropyridine-3-sulfonamide

N-(2-amino-1-cyclopentylethyl)-5-chloropyridine-3-sulfonamide (PubChem CID 120584957) has the molecular formula C12H18ClN3O2S and a molecular weight of 303.81 g/mol. Its IUPAC name is N-(2-amino-1-cyclopentylethyl)-5-chloropyridine-3-sulfonamide.

Molecular Properties

Compound NameN-(2-amino-1-cyclopentylethyl)-5-chloropyridine-3-sulfonamide
PubChem CID120584957
Molecular FormulaC12H18ClN3O2S
Molecular Weight303.81 g/mol
Exact Mass303.08
IUPAC NameN-(2-amino-1-cyclopentylethyl)-5-chloropyridine-3-sulfonamide
SMILESNCC(NS(=O)(=O)c1cncc(Cl)c1)C1CCCC1
InChIInChI=1S/C12H18ClN3O2S/c13-10-5-11(8-15-7-10)19(17,18)16-12(6-14)9-3-1-2-4-9/h5,7-9,12,16H,1-4,6,14H2
InChIKeyHNIQGRXRVBMDER-UHFFFAOYSA-N
XLogP1.53
TPSA85.08 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.81
LogP ≤ 51.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

6-chloro-N,N-di(propan-2-yl)pyridine-3-sulfonamide
CID 2433231
6-chloro-N-cyclohexylpyridine-3-sulfonamide
CID 822454
5,6-dichloro-N,N-diisobutyl-3-pyridinesulfonamide
CID 826892
N-(tert-butyl)-5,6-dichloro-3-pyridinesulfonamide
CID 826903
5,6-dichloro-N,N-diethyl-3-pyridinesulfonamide
CID 826913
6-chloro-N-[(4-sulfamoylphenyl)methyl]pyridine-3-sulfonamide
CID 4968561
4-chloro-N-[2-(dimethylamino)-2-pyridin-3-ylethyl]benzenesulfonamide
CID 5043635
6-Chloro-N-(4-methylcyclohexyl)pyridine-3-sulfonamide
CID 20116602
6-chloro-N-(4-chlorobenzyl)-3-pyridinesulfonamide
CID 826869
5,6-dichloro-N,N-dipropyl-3-pyridinesulfonamide
CID 826912
6-chloro-N-[2-(4-sulfamoylphenyl)ethyl]pyridine-3-sulfonamide
CID 2496433
N-benzyl-6-chloro-N-(propan-2-yl)pyridine-3-sulfonamide
CID 18273725

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-1-cyclopentylethyl)-5-chloropyridine-3-sulfonamide?
The IUPAC name of N-(2-amino-1-cyclopentylethyl)-5-chloropyridine-3-sulfonamide (CID 120584957) is N-(2-amino-1-cyclopentylethyl)-5-chloropyridine-3-sulfonamide.
What is the SMILES notation for N-(2-amino-1-cyclopentylethyl)-5-chloropyridine-3-sulfonamide?
The canonical SMILES for N-(2-amino-1-cyclopentylethyl)-5-chloropyridine-3-sulfonamide is NCC(NS(=O)(=O)c1cncc(Cl)c1)C1CCCC1.
What is the InChIKey of N-(2-amino-1-cyclopentylethyl)-5-chloropyridine-3-sulfonamide?
The InChIKey is HNIQGRXRVBMDER-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18ClN3O2S/c13-10-5-11(8-15-7-10)19(17,18)16-12(6-14)9-3-1-2-4-9/h5,7-9,12,16H,1-4,6,14H2.
What are the key properties of N-(2-amino-1-cyclopentylethyl)-5-chloropyridine-3-sulfonamide?
N-(2-amino-1-cyclopentylethyl)-5-chloropyridine-3-sulfonamide has a molecular weight of 303.81 g/mol, XLogP of 1.53, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-1-cyclopentylethyl)-5-chloropyridine-3-sulfonamide is sourced from PubChem (CID 120584957), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).