N,6-dimethyl-N-[2-methyl-5-(5-methylfuran-2-yl)phenyl]pyridine-3-sulfonamide

C19H20N2O3S — CID 158873106

IUPACN,6-dimethyl-N-[2-methyl-5-(5-methylfuran-2-yl)phenyl]pyridine-3-sulfonamide
SMILESCc1ccc(S(=O)(=O)N(C)c2cc(-c3ccc(C)o3)ccc2C)cn1
InChIInChI=1S/C19H20N2O3S/c1-13-5-8-16(19-10-7-15(3)24-19)11-18(13)21(4)25(22,23)17-9-6-14(2)20-12-17/h5-12H,1-4H3
InChIKeyJCBZMQJMGSFFOR-UHFFFAOYSA-N
MW356.45 g/mol
LogP4.09
Rot. Bonds4

About N,6-dimethyl-N-[2-methyl-5-(5-methylfuran-2-yl)phenyl]pyridine-3-sulfonamide

N,6-dimethyl-N-[2-methyl-5-(5-methylfuran-2-yl)phenyl]pyridine-3-sulfonamide (PubChem CID 158873106) has the molecular formula C19H20N2O3S and a molecular weight of 356.45 g/mol. Its IUPAC name is N,6-dimethyl-N-[2-methyl-5-(5-methylfuran-2-yl)phenyl]pyridine-3-sulfonamide.

Molecular Properties

Compound NameN,6-dimethyl-N-[2-methyl-5-(5-methylfuran-2-yl)phenyl]pyridine-3-sulfonamide
PubChem CID158873106
Molecular FormulaC19H20N2O3S
Molecular Weight356.45 g/mol
Exact Mass356.12
IUPAC NameN,6-dimethyl-N-[2-methyl-5-(5-methylfuran-2-yl)phenyl]pyridine-3-sulfonamide
SMILESCc1ccc(S(=O)(=O)N(C)c2cc(-c3ccc(C)o3)ccc2C)cn1
InChIInChI=1S/C19H20N2O3S/c1-13-5-8-16(19-10-7-15(3)24-19)11-18(13)21(4)25(22,23)17-9-6-14(2)20-12-17/h5-12H,1-4H3
InChIKeyJCBZMQJMGSFFOR-UHFFFAOYSA-N
XLogP4.09
TPSA63.41 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.45
LogP ≤ 54.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N,6-dimethyl-N-[2-methyl-5-(5-methylfuran-2-yl)phenyl]pyridine-3-sulfonamide?
The IUPAC name of N,6-dimethyl-N-[2-methyl-5-(5-methylfuran-2-yl)phenyl]pyridine-3-sulfonamide (CID 158873106) is N,6-dimethyl-N-[2-methyl-5-(5-methylfuran-2-yl)phenyl]pyridine-3-sulfonamide.
What is the SMILES notation for N,6-dimethyl-N-[2-methyl-5-(5-methylfuran-2-yl)phenyl]pyridine-3-sulfonamide?
The canonical SMILES for N,6-dimethyl-N-[2-methyl-5-(5-methylfuran-2-yl)phenyl]pyridine-3-sulfonamide is Cc1ccc(S(=O)(=O)N(C)c2cc(-c3ccc(C)o3)ccc2C)cn1.
What is the InChIKey of N,6-dimethyl-N-[2-methyl-5-(5-methylfuran-2-yl)phenyl]pyridine-3-sulfonamide?
The InChIKey is JCBZMQJMGSFFOR-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N2O3S/c1-13-5-8-16(19-10-7-15(3)24-19)11-18(13)21(4)25(22,23)17-9-6-14(2)20-12-17/h5-12H,1-4H3.
What are the key properties of N,6-dimethyl-N-[2-methyl-5-(5-methylfuran-2-yl)phenyl]pyridine-3-sulfonamide?
N,6-dimethyl-N-[2-methyl-5-(5-methylfuran-2-yl)phenyl]pyridine-3-sulfonamide has a molecular weight of 356.45 g/mol, XLogP of 4.09, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,6-dimethyl-N-[2-methyl-5-(5-methylfuran-2-yl)phenyl]pyridine-3-sulfonamide is sourced from PubChem (CID 158873106), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).