N-(3-cyanophenyl)-3-(ethylamino)pyridine-2-sulfonamide

C14H14N4O2S — CID 103303922

IUPACN-(3-cyanophenyl)-3-(ethylamino)pyridine-2-sulfonamide
SMILESCCNc1cccnc1S(=O)(=O)Nc1cccc(C#N)c1
InChIInChI=1S/C14H14N4O2S/c1-2-16-13-7-4-8-17-14(13)21(19,20)18-12-6-3-5-11(9-12)10-15/h3-9,16,18H,2H2,1H3
InChIKeyKNAIHGFMBGIRTC-UHFFFAOYSA-N
MW302.36 g/mol
LogP2.19
Rot. Bonds5

About N-(3-cyanophenyl)-3-(ethylamino)pyridine-2-sulfonamide

N-(3-cyanophenyl)-3-(ethylamino)pyridine-2-sulfonamide (PubChem CID 103303922) has the molecular formula C14H14N4O2S and a molecular weight of 302.36 g/mol. Its IUPAC name is N-(3-cyanophenyl)-3-(ethylamino)pyridine-2-sulfonamide.

Molecular Properties

Compound NameN-(3-cyanophenyl)-3-(ethylamino)pyridine-2-sulfonamide
PubChem CID103303922
Molecular FormulaC14H14N4O2S
Molecular Weight302.36 g/mol
Exact Mass302.08
IUPAC NameN-(3-cyanophenyl)-3-(ethylamino)pyridine-2-sulfonamide
SMILESCCNc1cccnc1S(=O)(=O)Nc1cccc(C#N)c1
InChIInChI=1S/C14H14N4O2S/c1-2-16-13-7-4-8-17-14(13)21(19,20)18-12-6-3-5-11(9-12)10-15/h3-9,16,18H,2H2,1H3
InChIKeyKNAIHGFMBGIRTC-UHFFFAOYSA-N
XLogP2.19
TPSA94.88 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.36
LogP ≤ 52.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(3-chloro-4-methylphenyl)-3-(ethylamino)pyridine-2-sulfonamide
CID 103303101
N-(3-fluorophenyl)-3-(propylamino)pyridine-2-sulfonamide
CID 103303892
N-(2-bromophenyl)-3-(ethylamino)pyridine-2-sulfonamide
CID 103303927
3-(ethylamino)-N-(6-methyl-2-pyridinyl)pyridine-2-sulfonamide
CID 103303472
3-(ethylamino)-N-(2-methylsulfanylphenyl)pyridine-2-sulfonamide
CID 107642917
N-(3-bromo-2-pyridinyl)-3-(ethylamino)pyridine-2-sulfonamide
CID 103306363
N-(2,4-difluorophenyl)-3-(ethylamino)pyridine-2-sulfonamide
CID 103304014
N-(4-chloro-2-iodophenyl)-3-(ethylamino)pyridine-2-sulfonamide
CID 107630627
N-(3,5-dimethyl-1H-pyrazol-4-yl)-3-(ethylamino)pyridine-2-sulfonamide
CID 103304698
N-(3-cyanophenyl)-2,6-difluorobenzenesulfonamide
CID 3712473
2,6-dichloro-N-(3-cyanophenyl)benzenesulfonamide
CID 26979574
N-(5-bromo-4-methyl-2-pyridinyl)-3-(ethylamino)pyridine-2-sulfonamide
CID 103306497

Frequently Asked Questions

What is the IUPAC name of N-(3-cyanophenyl)-3-(ethylamino)pyridine-2-sulfonamide?
The IUPAC name of N-(3-cyanophenyl)-3-(ethylamino)pyridine-2-sulfonamide (CID 103303922) is N-(3-cyanophenyl)-3-(ethylamino)pyridine-2-sulfonamide.
What is the SMILES notation for N-(3-cyanophenyl)-3-(ethylamino)pyridine-2-sulfonamide?
The canonical SMILES for N-(3-cyanophenyl)-3-(ethylamino)pyridine-2-sulfonamide is CCNc1cccnc1S(=O)(=O)Nc1cccc(C#N)c1.
What is the InChIKey of N-(3-cyanophenyl)-3-(ethylamino)pyridine-2-sulfonamide?
The InChIKey is KNAIHGFMBGIRTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N4O2S/c1-2-16-13-7-4-8-17-14(13)21(19,20)18-12-6-3-5-11(9-12)10-15/h3-9,16,18H,2H2,1H3.
What are the key properties of N-(3-cyanophenyl)-3-(ethylamino)pyridine-2-sulfonamide?
N-(3-cyanophenyl)-3-(ethylamino)pyridine-2-sulfonamide has a molecular weight of 302.36 g/mol, XLogP of 2.19, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-cyanophenyl)-3-(ethylamino)pyridine-2-sulfonamide is sourced from PubChem (CID 103303922), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).