N-[4-(methanesulfonamido)phenyl]-6-methylpyridine-2-carboxamide

C14H15N3O3S — CID 32696107

IUPACN-[4-(methanesulfonamido)phenyl]-6-methylpyridine-2-carboxamide
SMILESCc1cccc(C(=O)Nc2ccc(NS(C)(=O)=O)cc2)n1
InChIInChI=1S/C14H15N3O3S/c1-10-4-3-5-13(15-10)14(18)16-11-6-8-12(9-7-11)17-21(2,19)20/h3-9,17H,1-2H3,(H,16,18)
InChIKeyIEWZXXSKCJQWCD-UHFFFAOYSA-N
MW305.36 g/mol
LogP2.01
Rot. Bonds4

About N-[4-(methanesulfonamido)phenyl]-6-methylpyridine-2-carboxamide

N-[4-(methanesulfonamido)phenyl]-6-methylpyridine-2-carboxamide (PubChem CID 32696107) has the molecular formula C14H15N3O3S and a molecular weight of 305.36 g/mol. Its IUPAC name is N-[4-(methanesulfonamido)phenyl]-6-methylpyridine-2-carboxamide.

Molecular Properties

Compound NameN-[4-(methanesulfonamido)phenyl]-6-methylpyridine-2-carboxamide
PubChem CID32696107
Molecular FormulaC14H15N3O3S
Molecular Weight305.36 g/mol
Exact Mass305.08
IUPAC NameN-[4-(methanesulfonamido)phenyl]-6-methylpyridine-2-carboxamide
SMILESCc1cccc(C(=O)Nc2ccc(NS(C)(=O)=O)cc2)n1
InChIInChI=1S/C14H15N3O3S/c1-10-4-3-5-13(15-10)14(18)16-11-6-8-12(9-7-11)17-21(2,19)20/h3-9,17H,1-2H3,(H,16,18)
InChIKeyIEWZXXSKCJQWCD-UHFFFAOYSA-N
XLogP2.01
TPSA88.16 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.36
LogP ≤ 52.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[4-(methanesulfonamido)phenyl]-6-methylpyridine-2-carboxamide?
The IUPAC name of N-[4-(methanesulfonamido)phenyl]-6-methylpyridine-2-carboxamide (CID 32696107) is N-[4-(methanesulfonamido)phenyl]-6-methylpyridine-2-carboxamide.
What is the SMILES notation for N-[4-(methanesulfonamido)phenyl]-6-methylpyridine-2-carboxamide?
The canonical SMILES for N-[4-(methanesulfonamido)phenyl]-6-methylpyridine-2-carboxamide is Cc1cccc(C(=O)Nc2ccc(NS(C)(=O)=O)cc2)n1.
What is the InChIKey of N-[4-(methanesulfonamido)phenyl]-6-methylpyridine-2-carboxamide?
The InChIKey is IEWZXXSKCJQWCD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N3O3S/c1-10-4-3-5-13(15-10)14(18)16-11-6-8-12(9-7-11)17-21(2,19)20/h3-9,17H,1-2H3,(H,16,18).
What are the key properties of N-[4-(methanesulfonamido)phenyl]-6-methylpyridine-2-carboxamide?
N-[4-(methanesulfonamido)phenyl]-6-methylpyridine-2-carboxamide has a molecular weight of 305.36 g/mol, XLogP of 2.01, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(methanesulfonamido)phenyl]-6-methylpyridine-2-carboxamide is sourced from PubChem (CID 32696107), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).