5-(ethylaminomethyl)-N-(2H-tetrazol-5-ylmethyl)pyridine-2-sulfonamide

C10H15N7O2S — CID 106051487

IUPAC5-(ethylaminomethyl)-N-(2H-tetrazol-5-ylmethyl)pyridine-2-sulfonamide
SMILESCCNCc1ccc(S(=O)(=O)NCc2nn[nH]n2)nc1
InChIInChI=1S/C10H15N7O2S/c1-2-11-5-8-3-4-10(12-6-8)20(18,19)13-7-9-14-16-17-15-9/h3-4,6,11,13H,2,5,7H2,1H3,(H,14,15,16,17)
InChIKeyUPDAVPCBZODIQK-UHFFFAOYSA-N
MW297.34 g/mol
LogP-0.82
Rot. Bonds7

About 5-(ethylaminomethyl)-N-(2H-tetrazol-5-ylmethyl)pyridine-2-sulfonamide

5-(ethylaminomethyl)-N-(2H-tetrazol-5-ylmethyl)pyridine-2-sulfonamide (PubChem CID 106051487) has the molecular formula C10H15N7O2S and a molecular weight of 297.34 g/mol. Its IUPAC name is 5-(ethylaminomethyl)-N-(2H-tetrazol-5-ylmethyl)pyridine-2-sulfonamide.

Molecular Properties

Compound Name5-(ethylaminomethyl)-N-(2H-tetrazol-5-ylmethyl)pyridine-2-sulfonamide
PubChem CID106051487
Molecular FormulaC10H15N7O2S
Molecular Weight297.34 g/mol
Exact Mass297.10
IUPAC Name5-(ethylaminomethyl)-N-(2H-tetrazol-5-ylmethyl)pyridine-2-sulfonamide
SMILESCCNCc1ccc(S(=O)(=O)NCc2nn[nH]n2)nc1
InChIInChI=1S/C10H15N7O2S/c1-2-11-5-8-3-4-10(12-6-8)20(18,19)13-7-9-14-16-17-15-9/h3-4,6,11,13H,2,5,7H2,1H3,(H,14,15,16,17)
InChIKeyUPDAVPCBZODIQK-UHFFFAOYSA-N
XLogP-0.82
TPSA125.55 Ų
H-Bond Donors3
H-Bond Acceptors7
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.34
LogP ≤ 5-0.82
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 107

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Related Compounds

5-(ethylaminomethyl)-N-[(4-methyl-1,2,4-triazol-3-yl)methyl]pyridine-2-sulfonamide
CID 106016201
5-(ethylaminomethyl)-N-pyrimidin-5-ylpyridine-2-sulfonamide
CID 106088578
5-(ethylaminomethyl)-N-(3-methylsulfanylpropyl)pyridine-2-sulfonamide
CID 106066192
5-(ethylaminomethyl)-N-(3-propoxypropyl)pyridine-2-sulfonamide
CID 106074139
N-(2-butoxyethyl)-5-(ethylaminomethyl)pyridine-2-sulfonamide
CID 106017521
5-(ethylaminomethyl)-N-(5-methoxypentyl)pyridine-2-sulfonamide
CID 106092686
4-(ethylamino)-N-(2H-tetrazol-5-ylmethyl)benzenesulfonamide
CID 62157363
1-(6-methoxy-3-pyridinyl)-N-(2H-tetrazol-5-ylmethyl)methanamine
CID 114936716
5-(ethylaminomethyl)-N-(1-methoxy-2-methylpropan-2-yl)pyridine-2-sulfonamide
CID 106080557
5-(ethylaminomethyl)-N-(4-methylhexan-2-yl)pyridine-2-sulfonamide
CID 106066707
5-(propylaminomethyl)-N-(1H-1,2,4-triazol-5-ylmethyl)pyridine-2-sulfonamide
CID 106013375
3-(ethylamino)-N-(2H-tetrazol-5-ylmethyl)pyridine-2-sulfonamide
CID 103305294

Frequently Asked Questions

What is the IUPAC name of 5-(ethylaminomethyl)-N-(2H-tetrazol-5-ylmethyl)pyridine-2-sulfonamide?
The IUPAC name of 5-(ethylaminomethyl)-N-(2H-tetrazol-5-ylmethyl)pyridine-2-sulfonamide (CID 106051487) is 5-(ethylaminomethyl)-N-(2H-tetrazol-5-ylmethyl)pyridine-2-sulfonamide.
What is the SMILES notation for 5-(ethylaminomethyl)-N-(2H-tetrazol-5-ylmethyl)pyridine-2-sulfonamide?
The canonical SMILES for 5-(ethylaminomethyl)-N-(2H-tetrazol-5-ylmethyl)pyridine-2-sulfonamide is CCNCc1ccc(S(=O)(=O)NCc2nn[nH]n2)nc1.
What is the InChIKey of 5-(ethylaminomethyl)-N-(2H-tetrazol-5-ylmethyl)pyridine-2-sulfonamide?
The InChIKey is UPDAVPCBZODIQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N7O2S/c1-2-11-5-8-3-4-10(12-6-8)20(18,19)13-7-9-14-16-17-15-9/h3-4,6,11,13H,2,5,7H2,1H3,(H,14,15,16,17).
What are the key properties of 5-(ethylaminomethyl)-N-(2H-tetrazol-5-ylmethyl)pyridine-2-sulfonamide?
5-(ethylaminomethyl)-N-(2H-tetrazol-5-ylmethyl)pyridine-2-sulfonamide has a molecular weight of 297.34 g/mol, XLogP of -0.82, 7 rotatable bonds, 3 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(ethylaminomethyl)-N-(2H-tetrazol-5-ylmethyl)pyridine-2-sulfonamide is sourced from PubChem (CID 106051487), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).