N-(1-cyclobutylethyl)-5-(ethylaminomethyl)pyridine-2-sulfonamide

C14H23N3O2S — CID 106084753

IUPACN-(1-cyclobutylethyl)-5-(ethylaminomethyl)pyridine-2-sulfonamide
SMILESCCNCc1ccc(S(=O)(=O)NC(C)C2CCC2)nc1
InChIInChI=1S/C14H23N3O2S/c1-3-15-9-12-7-8-14(16-10-12)20(18,19)17-11(2)13-5-4-6-13/h7-8,10-11,13,15,17H,3-6,9H2,1-2H3
InChIKeyAGTBAEYHQZNBTC-UHFFFAOYSA-N
MW297.42 g/mol
LogP1.66
Rot. Bonds7

About N-(1-cyclobutylethyl)-5-(ethylaminomethyl)pyridine-2-sulfonamide

N-(1-cyclobutylethyl)-5-(ethylaminomethyl)pyridine-2-sulfonamide (PubChem CID 106084753) has the molecular formula C14H23N3O2S and a molecular weight of 297.42 g/mol. Its IUPAC name is N-(1-cyclobutylethyl)-5-(ethylaminomethyl)pyridine-2-sulfonamide.

Molecular Properties

Compound NameN-(1-cyclobutylethyl)-5-(ethylaminomethyl)pyridine-2-sulfonamide
PubChem CID106084753
Molecular FormulaC14H23N3O2S
Molecular Weight297.42 g/mol
Exact Mass297.15
IUPAC NameN-(1-cyclobutylethyl)-5-(ethylaminomethyl)pyridine-2-sulfonamide
SMILESCCNCc1ccc(S(=O)(=O)NC(C)C2CCC2)nc1
InChIInChI=1S/C14H23N3O2S/c1-3-15-9-12-7-8-14(16-10-12)20(18,19)17-11(2)13-5-4-6-13/h7-8,10-11,13,15,17H,3-6,9H2,1-2H3
InChIKeyAGTBAEYHQZNBTC-UHFFFAOYSA-N
XLogP1.66
TPSA71.09 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.42
LogP ≤ 51.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

5-(ethylaminomethyl)-N-(4-methylhexan-2-yl)pyridine-2-sulfonamide
CID 106066707
N-(1-cyclopentylethyl)-4-(ethylaminomethyl)thiophene-2-sulfonamide
CID 106066079
N-(1-cyclohexylethyl)-4-(ethylaminomethyl)thiophene-2-sulfonamide
CID 106056863
N-(1-cyclobutylethyl)-1-[3-(ethylaminomethyl)phenyl]methanesulfonamide
CID 106084807
5-(ethylaminomethyl)-N-pyrimidin-5-ylpyridine-2-sulfonamide
CID 106088578
N-(1-cyclobutylethyl)-5-(ethylaminomethyl)-1H-pyrrole-3-sulfonamide
CID 106084907
N-cyclooctyl-5-(methylaminomethyl)pyridine-2-sulfonamide
CID 106058846
5-(ethylaminomethyl)-N-(1-methoxy-2-methylpropan-2-yl)pyridine-2-sulfonamide
CID 106080557
5-(ethylaminomethyl)-N-(3-propoxypropyl)pyridine-2-sulfonamide
CID 106074139
N-(2-butoxyethyl)-5-(ethylaminomethyl)pyridine-2-sulfonamide
CID 106017521
5-(aminomethyl)-N-(1-cyclopropylbutan-2-yl)pyridine-2-sulfonamide
CID 106064004
N-(cyclopentylmethyl)-5-[(propan-2-ylamino)methyl]pyridine-2-sulfonamide
CID 106026792

Frequently Asked Questions

What is the IUPAC name of N-(1-cyclobutylethyl)-5-(ethylaminomethyl)pyridine-2-sulfonamide?
The IUPAC name of N-(1-cyclobutylethyl)-5-(ethylaminomethyl)pyridine-2-sulfonamide (CID 106084753) is N-(1-cyclobutylethyl)-5-(ethylaminomethyl)pyridine-2-sulfonamide.
What is the SMILES notation for N-(1-cyclobutylethyl)-5-(ethylaminomethyl)pyridine-2-sulfonamide?
The canonical SMILES for N-(1-cyclobutylethyl)-5-(ethylaminomethyl)pyridine-2-sulfonamide is CCNCc1ccc(S(=O)(=O)NC(C)C2CCC2)nc1.
What is the InChIKey of N-(1-cyclobutylethyl)-5-(ethylaminomethyl)pyridine-2-sulfonamide?
The InChIKey is AGTBAEYHQZNBTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3O2S/c1-3-15-9-12-7-8-14(16-10-12)20(18,19)17-11(2)13-5-4-6-13/h7-8,10-11,13,15,17H,3-6,9H2,1-2H3.
What are the key properties of N-(1-cyclobutylethyl)-5-(ethylaminomethyl)pyridine-2-sulfonamide?
N-(1-cyclobutylethyl)-5-(ethylaminomethyl)pyridine-2-sulfonamide has a molecular weight of 297.42 g/mol, XLogP of 1.66, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-cyclobutylethyl)-5-(ethylaminomethyl)pyridine-2-sulfonamide is sourced from PubChem (CID 106084753), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).