6-(aminomethyl)-N-(6-methoxy-3-pyridinyl)pyridine-3-sulfonamide

C12H14N4O3S — CID 114613006

IUPAC6-(aminomethyl)-N-(6-methoxy-3-pyridinyl)pyridine-3-sulfonamide
SMILESCOc1ccc(NS(=O)(=O)c2ccc(CN)nc2)cn1
InChIInChI=1S/C12H14N4O3S/c1-19-12-5-3-10(7-15-12)16-20(17,18)11-4-2-9(6-13)14-8-11/h2-5,7-8,16H,6,13H2,1H3
InChIKeyKSDMQDKDYNQSGK-UHFFFAOYSA-N
MW294.34 g/mol
LogP0.74
Rot. Bonds5

About 6-(aminomethyl)-N-(6-methoxy-3-pyridinyl)pyridine-3-sulfonamide

6-(aminomethyl)-N-(6-methoxy-3-pyridinyl)pyridine-3-sulfonamide (PubChem CID 114613006) has the molecular formula C12H14N4O3S and a molecular weight of 294.34 g/mol. Its IUPAC name is 6-(aminomethyl)-N-(6-methoxy-3-pyridinyl)pyridine-3-sulfonamide.

Molecular Properties

Compound Name6-(aminomethyl)-N-(6-methoxy-3-pyridinyl)pyridine-3-sulfonamide
PubChem CID114613006
Molecular FormulaC12H14N4O3S
Molecular Weight294.34 g/mol
Exact Mass294.08
IUPAC Name6-(aminomethyl)-N-(6-methoxy-3-pyridinyl)pyridine-3-sulfonamide
SMILESCOc1ccc(NS(=O)(=O)c2ccc(CN)nc2)cn1
InChIInChI=1S/C12H14N4O3S/c1-19-12-5-3-10(7-15-12)16-20(17,18)11-4-2-9(6-13)14-8-11/h2-5,7-8,16H,6,13H2,1H3
InChIKeyKSDMQDKDYNQSGK-UHFFFAOYSA-N
XLogP0.74
TPSA107.20 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.34
LogP ≤ 50.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

6-amino-N-(6-methoxy-3-pyridinyl)pyridine-3-sulfonamide
CID 62149708
6-(ethylamino)-N-(6-methoxy-3-pyridinyl)pyridine-3-sulfonamide
CID 62150604
6-(aminomethyl)-N-(4-ethoxyphenyl)pyridine-3-sulfonamide
CID 114613079
5-(aminomethyl)-N-(6-methoxy-3-pyridinyl)-4-methylthiophene-2-sulfonamide
CID 106059973
2-methoxy-5-(sulfamoylamino)pyridine
CID 112573201
2-hydrazinyl-N-(6-methoxy-3-pyridinyl)pyridine-4-sulfonamide
CID 61004702
N-(6-methoxy-3-pyridinyl)-4-(trifluoromethoxy)benzenesulfonamide
CID 40664381
5-chloro-6-hydrazinyl-N-(6-methoxy-3-pyridinyl)pyridine-3-sulfonamide
CID 64606447
3-hydroxy-N-(6-methoxy-3-pyridinyl)benzenesulfonamide
CID 81259188
4-(cyclopropanecarbonyl)-N-(6-methoxy-3-pyridinyl)benzenesulfonamide
CID 110620835
2-amino-4-bromo-N-(6-methoxy-3-pyridinyl)benzenesulfonamide
CID 43257274
N-(6-methoxy-3-pyridinyl)-1-[2-(methylamino)ethyl]pyrazole-4-sulfonamide
CID 106059980

Frequently Asked Questions

What is the IUPAC name of 6-(aminomethyl)-N-(6-methoxy-3-pyridinyl)pyridine-3-sulfonamide?
The IUPAC name of 6-(aminomethyl)-N-(6-methoxy-3-pyridinyl)pyridine-3-sulfonamide (CID 114613006) is 6-(aminomethyl)-N-(6-methoxy-3-pyridinyl)pyridine-3-sulfonamide.
What is the SMILES notation for 6-(aminomethyl)-N-(6-methoxy-3-pyridinyl)pyridine-3-sulfonamide?
The canonical SMILES for 6-(aminomethyl)-N-(6-methoxy-3-pyridinyl)pyridine-3-sulfonamide is COc1ccc(NS(=O)(=O)c2ccc(CN)nc2)cn1.
What is the InChIKey of 6-(aminomethyl)-N-(6-methoxy-3-pyridinyl)pyridine-3-sulfonamide?
The InChIKey is KSDMQDKDYNQSGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N4O3S/c1-19-12-5-3-10(7-15-12)16-20(17,18)11-4-2-9(6-13)14-8-11/h2-5,7-8,16H,6,13H2,1H3.
What are the key properties of 6-(aminomethyl)-N-(6-methoxy-3-pyridinyl)pyridine-3-sulfonamide?
6-(aminomethyl)-N-(6-methoxy-3-pyridinyl)pyridine-3-sulfonamide has a molecular weight of 294.34 g/mol, XLogP of 0.74, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(aminomethyl)-N-(6-methoxy-3-pyridinyl)pyridine-3-sulfonamide is sourced from PubChem (CID 114613006), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).