N-(4-pyrimidin-2-yloxyphenyl)methanesulfonamide

C11H11N3O3S — CID 1487543

IUPACN-(4-pyrimidin-2-yloxyphenyl)methanesulfonamide
SMILESCS(=O)(=O)Nc1ccc(Oc2ncccn2)cc1
InChIInChI=1S/C11H11N3O3S/c1-18(15,16)14-9-3-5-10(6-4-9)17-11-12-7-2-8-13-11/h2-8,14H,1H3
InChIKeyIFMNGHNXIOKAPZ-UHFFFAOYSA-N
MW265.29 g/mol
LogP1.64
Rot. Bonds4

About N-(4-pyrimidin-2-yloxyphenyl)methanesulfonamide

N-(4-pyrimidin-2-yloxyphenyl)methanesulfonamide (PubChem CID 1487543) has the molecular formula C11H11N3O3S and a molecular weight of 265.29 g/mol. Its IUPAC name is N-(4-pyrimidin-2-yloxyphenyl)methanesulfonamide.

Molecular Properties

Compound NameN-(4-pyrimidin-2-yloxyphenyl)methanesulfonamide
PubChem CID1487543
Molecular FormulaC11H11N3O3S
Molecular Weight265.29 g/mol
Exact Mass265.05
IUPAC NameN-(4-pyrimidin-2-yloxyphenyl)methanesulfonamide
SMILESCS(=O)(=O)Nc1ccc(Oc2ncccn2)cc1
InChIInChI=1S/C11H11N3O3S/c1-18(15,16)14-9-3-5-10(6-4-9)17-11-12-7-2-8-13-11/h2-8,14H,1H3
InChIKeyIFMNGHNXIOKAPZ-UHFFFAOYSA-N
XLogP1.64
TPSA81.18 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.29
LogP ≤ 51.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(4-pyrimidin-2-yloxyphenyl)methanesulfonamide?
The IUPAC name of N-(4-pyrimidin-2-yloxyphenyl)methanesulfonamide (CID 1487543) is N-(4-pyrimidin-2-yloxyphenyl)methanesulfonamide.
What is the SMILES notation for N-(4-pyrimidin-2-yloxyphenyl)methanesulfonamide?
The canonical SMILES for N-(4-pyrimidin-2-yloxyphenyl)methanesulfonamide is CS(=O)(=O)Nc1ccc(Oc2ncccn2)cc1.
What is the InChIKey of N-(4-pyrimidin-2-yloxyphenyl)methanesulfonamide?
The InChIKey is IFMNGHNXIOKAPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11N3O3S/c1-18(15,16)14-9-3-5-10(6-4-9)17-11-12-7-2-8-13-11/h2-8,14H,1H3.
What are the key properties of N-(4-pyrimidin-2-yloxyphenyl)methanesulfonamide?
N-(4-pyrimidin-2-yloxyphenyl)methanesulfonamide has a molecular weight of 265.29 g/mol, XLogP of 1.64, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-pyrimidin-2-yloxyphenyl)methanesulfonamide is sourced from PubChem (CID 1487543), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).