5-(aminomethyl)-N-[1-(diethylamino)propan-2-yl]pyridine-2-sulfonamide

C13H24N4O2S — CID 106052257

IUPAC5-(aminomethyl)-N-[1-(diethylamino)propan-2-yl]pyridine-2-sulfonamide
SMILESCCN(CC)CC(C)NS(=O)(=O)c1ccc(CN)cn1
InChIInChI=1S/C13H24N4O2S/c1-4-17(5-2)10-11(3)16-20(18,19)13-7-6-12(8-14)9-15-13/h6-7,9,11,16H,4-5,8,10,14H2,1-3H3
InChIKeyMHAOZEYKLIZPGD-UHFFFAOYSA-N
MW300.43 g/mol
LogP0.55
Rot. Bonds8

About 5-(aminomethyl)-N-[1-(diethylamino)propan-2-yl]pyridine-2-sulfonamide

5-(aminomethyl)-N-[1-(diethylamino)propan-2-yl]pyridine-2-sulfonamide (PubChem CID 106052257) has the molecular formula C13H24N4O2S and a molecular weight of 300.43 g/mol. Its IUPAC name is 5-(aminomethyl)-N-[1-(diethylamino)propan-2-yl]pyridine-2-sulfonamide.

Molecular Properties

Compound Name5-(aminomethyl)-N-[1-(diethylamino)propan-2-yl]pyridine-2-sulfonamide
PubChem CID106052257
Molecular FormulaC13H24N4O2S
Molecular Weight300.43 g/mol
Exact Mass300.16
IUPAC Name5-(aminomethyl)-N-[1-(diethylamino)propan-2-yl]pyridine-2-sulfonamide
SMILESCCN(CC)CC(C)NS(=O)(=O)c1ccc(CN)cn1
InChIInChI=1S/C13H24N4O2S/c1-4-17(5-2)10-11(3)16-20(18,19)13-7-6-12(8-14)9-15-13/h6-7,9,11,16H,4-5,8,10,14H2,1-3H3
InChIKeyMHAOZEYKLIZPGD-UHFFFAOYSA-N
XLogP0.55
TPSA88.32 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.43
LogP ≤ 50.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

5-(aminomethyl)-N-(1-cyclopropylbutan-2-yl)pyridine-2-sulfonamide
CID 106064004
5-(aminomethyl)-N-(1-pyridin-2-ylethyl)pyridine-2-sulfonamide
CID 106022983
5-(aminomethyl)-N-[1-(1H-pyrazol-4-yl)ethyl]pyridine-2-sulfonamide
CID 106218530
2-amino-N-[1-(diethylamino)propan-2-yl]pyridine-4-sulfonamide
CID 62158649
5-(ethylaminomethyl)-N-(4-methylhexan-2-yl)pyridine-2-sulfonamide
CID 106066707
5-(aminomethyl)-N-(2-ethoxyethyl)pyridine-2-sulfonamide
CID 106020136
5-(aminomethyl)-2-bromo-N-[1-(diethylamino)propan-2-yl]furan-3-sulfonamide
CID 106052222
N-(4-ethylsulfanylbutan-2-yl)-5-(methylaminomethyl)pyridine-2-sulfonamide
CID 106084685
N-[1-(diethylamino)propan-2-yl]-2-(methylamino)pyridine-4-sulfonamide
CID 62158114
5-(aminomethyl)-N-(5-bromo-4-methyl-2-pyridinyl)pyridine-2-sulfonamide
CID 106070858
5-(aminomethyl)-N-(2,6-dibromo-4-methylphenyl)pyridine-2-sulfonamide
CID 106002333
5-(aminomethyl)-N-(2-ethylcyclohexyl)pyridine-2-sulfonamide
CID 106002921

Frequently Asked Questions

What is the IUPAC name of 5-(aminomethyl)-N-[1-(diethylamino)propan-2-yl]pyridine-2-sulfonamide?
The IUPAC name of 5-(aminomethyl)-N-[1-(diethylamino)propan-2-yl]pyridine-2-sulfonamide (CID 106052257) is 5-(aminomethyl)-N-[1-(diethylamino)propan-2-yl]pyridine-2-sulfonamide.
What is the SMILES notation for 5-(aminomethyl)-N-[1-(diethylamino)propan-2-yl]pyridine-2-sulfonamide?
The canonical SMILES for 5-(aminomethyl)-N-[1-(diethylamino)propan-2-yl]pyridine-2-sulfonamide is CCN(CC)CC(C)NS(=O)(=O)c1ccc(CN)cn1.
What is the InChIKey of 5-(aminomethyl)-N-[1-(diethylamino)propan-2-yl]pyridine-2-sulfonamide?
The InChIKey is MHAOZEYKLIZPGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N4O2S/c1-4-17(5-2)10-11(3)16-20(18,19)13-7-6-12(8-14)9-15-13/h6-7,9,11,16H,4-5,8,10,14H2,1-3H3.
What are the key properties of 5-(aminomethyl)-N-[1-(diethylamino)propan-2-yl]pyridine-2-sulfonamide?
5-(aminomethyl)-N-[1-(diethylamino)propan-2-yl]pyridine-2-sulfonamide has a molecular weight of 300.43 g/mol, XLogP of 0.55, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(aminomethyl)-N-[1-(diethylamino)propan-2-yl]pyridine-2-sulfonamide is sourced from PubChem (CID 106052257), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).