5-(aminomethyl)-N-(1-cyclopropylbutan-2-yl)pyridine-2-sulfonamide

C13H21N3O2S — CID 106064004

IUPAC5-(aminomethyl)-N-(1-cyclopropylbutan-2-yl)pyridine-2-sulfonamide
SMILESCCC(CC1CC1)NS(=O)(=O)c1ccc(CN)cn1
InChIInChI=1S/C13H21N3O2S/c1-2-12(7-10-3-4-10)16-19(17,18)13-6-5-11(8-14)9-15-13/h5-6,9-10,12,16H,2-4,7-8,14H2,1H3
InChIKeyYRNXJDRWLJSWHY-UHFFFAOYSA-N
MW283.40 g/mol
LogP1.40
Rot. Bonds7

About 5-(aminomethyl)-N-(1-cyclopropylbutan-2-yl)pyridine-2-sulfonamide

5-(aminomethyl)-N-(1-cyclopropylbutan-2-yl)pyridine-2-sulfonamide (PubChem CID 106064004) has the molecular formula C13H21N3O2S and a molecular weight of 283.40 g/mol. Its IUPAC name is 5-(aminomethyl)-N-(1-cyclopropylbutan-2-yl)pyridine-2-sulfonamide.

Molecular Properties

Compound Name5-(aminomethyl)-N-(1-cyclopropylbutan-2-yl)pyridine-2-sulfonamide
PubChem CID106064004
Molecular FormulaC13H21N3O2S
Molecular Weight283.40 g/mol
Exact Mass283.14
IUPAC Name5-(aminomethyl)-N-(1-cyclopropylbutan-2-yl)pyridine-2-sulfonamide
SMILESCCC(CC1CC1)NS(=O)(=O)c1ccc(CN)cn1
InChIInChI=1S/C13H21N3O2S/c1-2-12(7-10-3-4-10)16-19(17,18)13-6-5-11(8-14)9-15-13/h5-6,9-10,12,16H,2-4,7-8,14H2,1H3
InChIKeyYRNXJDRWLJSWHY-UHFFFAOYSA-N
XLogP1.40
TPSA85.08 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.40
LogP ≤ 51.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

5-(aminomethyl)-N-(2-ethylcyclohexyl)pyridine-2-sulfonamide
CID 106002921
5-(aminomethyl)-N-[1-(diethylamino)propan-2-yl]pyridine-2-sulfonamide
CID 106052257
5-(aminomethyl)-N-(3-methylcyclopentyl)pyridine-2-sulfonamide
CID 114552024
3-(aminomethyl)-N-(1-cyclopropylbutan-2-yl)-4-ethylbenzenesulfonamide
CID 106063935
5-(aminomethyl)-N-[1-(1H-pyrazol-4-yl)ethyl]pyridine-2-sulfonamide
CID 106218530
2-amino-N-(1-cyclopropylbutan-2-yl)benzenesulfonamide
CID 63994606
N-(1-cyclopropylbutan-2-yl)-1H-pyrazole-4-sulfonamide
CID 63995174
3-amino-N-(1-cyclopropylbutan-2-yl)benzenesulfonamide
CID 63995414
5-(aminomethyl)-N-(1-pyridin-2-ylethyl)pyridine-2-sulfonamide
CID 106022983
N-(1-cyclopropylbutan-2-yl)-1H-pyrazole-5-sulfonamide
CID 102693054
2-amino-5-bromo-N-(1-cyclopropylbutan-2-yl)pyridine-3-sulfonamide
CID 63994409
2-(sulfamoylamino)butylcyclopropane
CID 112690847

Frequently Asked Questions

What is the IUPAC name of 5-(aminomethyl)-N-(1-cyclopropylbutan-2-yl)pyridine-2-sulfonamide?
The IUPAC name of 5-(aminomethyl)-N-(1-cyclopropylbutan-2-yl)pyridine-2-sulfonamide (CID 106064004) is 5-(aminomethyl)-N-(1-cyclopropylbutan-2-yl)pyridine-2-sulfonamide.
What is the SMILES notation for 5-(aminomethyl)-N-(1-cyclopropylbutan-2-yl)pyridine-2-sulfonamide?
The canonical SMILES for 5-(aminomethyl)-N-(1-cyclopropylbutan-2-yl)pyridine-2-sulfonamide is CCC(CC1CC1)NS(=O)(=O)c1ccc(CN)cn1.
What is the InChIKey of 5-(aminomethyl)-N-(1-cyclopropylbutan-2-yl)pyridine-2-sulfonamide?
The InChIKey is YRNXJDRWLJSWHY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N3O2S/c1-2-12(7-10-3-4-10)16-19(17,18)13-6-5-11(8-14)9-15-13/h5-6,9-10,12,16H,2-4,7-8,14H2,1H3.
What are the key properties of 5-(aminomethyl)-N-(1-cyclopropylbutan-2-yl)pyridine-2-sulfonamide?
5-(aminomethyl)-N-(1-cyclopropylbutan-2-yl)pyridine-2-sulfonamide has a molecular weight of 283.40 g/mol, XLogP of 1.40, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(aminomethyl)-N-(1-cyclopropylbutan-2-yl)pyridine-2-sulfonamide is sourced from PubChem (CID 106064004), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).