2-(ethylamino)-N-(1,2-oxazol-3-yl)pyrimidine-5-sulfonamide

C9H11N5O3S — CID 62902362

IUPAC2-(ethylamino)-N-(1,2-oxazol-3-yl)pyrimidine-5-sulfonamide
SMILESCCNc1ncc(S(=O)(=O)Nc2ccon2)cn1
InChIInChI=1S/C9H11N5O3S/c1-2-10-9-11-5-7(6-12-9)18(15,16)14-8-3-4-17-13-8/h3-6H,2H2,1H3,(H,13,14)(H,10,11,12)
InChIKeyAOSZJASGYFGIHB-UHFFFAOYSA-N
MW269.29 g/mol
LogP0.70
Rot. Bonds5

About 2-(ethylamino)-N-(1,2-oxazol-3-yl)pyrimidine-5-sulfonamide

2-(ethylamino)-N-(1,2-oxazol-3-yl)pyrimidine-5-sulfonamide (PubChem CID 62902362) has the molecular formula C9H11N5O3S and a molecular weight of 269.29 g/mol. Its IUPAC name is 2-(ethylamino)-N-(1,2-oxazol-3-yl)pyrimidine-5-sulfonamide.

Molecular Properties

Compound Name2-(ethylamino)-N-(1,2-oxazol-3-yl)pyrimidine-5-sulfonamide
PubChem CID62902362
Molecular FormulaC9H11N5O3S
Molecular Weight269.29 g/mol
Exact Mass269.06
IUPAC Name2-(ethylamino)-N-(1,2-oxazol-3-yl)pyrimidine-5-sulfonamide
SMILESCCNc1ncc(S(=O)(=O)Nc2ccon2)cn1
InChIInChI=1S/C9H11N5O3S/c1-2-10-9-11-5-7(6-12-9)18(15,16)14-8-3-4-17-13-8/h3-6H,2H2,1H3,(H,13,14)(H,10,11,12)
InChIKeyAOSZJASGYFGIHB-UHFFFAOYSA-N
XLogP0.70
TPSA110.01 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.29
LogP ≤ 50.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Related Compounds

2-(ethylamino)-N-pyridin-2-ylpyrimidine-5-sulfonamide
CID 62149006
2-(ethylamino)-N-(5-methyl-2-pyridinyl)pyrimidine-5-sulfonamide
CID 62150826
2-(ethylamino)-N-pyrazin-2-ylpyrimidine-5-sulfonamide
CID 62148086
2-(ethylamino)-N-(4-methylphenyl)pyrimidine-5-sulfonamide
CID 62144386
N-(1,2-oxazol-3-yl)-4-(propylamino)benzenesulfonamide
CID 62904312
4-(ethylamino)-3-nitro-N-(1,2-oxazol-3-yl)benzenesulfonamide
CID 62904139
N-(2,5-dimethylpyrazol-3-yl)-2-(ethylamino)pyrimidine-5-sulfonamide
CID 62142994
N-(1,2-oxazol-3-yl)-1H-pyrazole-4-sulfonamide
CID 62904646
N-ethyl-1,2-oxazol-3-amine;hydrochloride
CID 89422608
N-(3-chlorophenyl)-2-(ethylamino)pyrimidine-5-sulfonamide
CID 62144333
2-(ethylamino)-N-(4-fluoro-2-iodophenyl)pyrimidine-5-sulfonamide
CID 79762345
N-(5-bromo-2-methylphenyl)-2-(ethylamino)pyrimidine-5-sulfonamide
CID 62146677

Frequently Asked Questions

What is the IUPAC name of 2-(ethylamino)-N-(1,2-oxazol-3-yl)pyrimidine-5-sulfonamide?
The IUPAC name of 2-(ethylamino)-N-(1,2-oxazol-3-yl)pyrimidine-5-sulfonamide (CID 62902362) is 2-(ethylamino)-N-(1,2-oxazol-3-yl)pyrimidine-5-sulfonamide.
What is the SMILES notation for 2-(ethylamino)-N-(1,2-oxazol-3-yl)pyrimidine-5-sulfonamide?
The canonical SMILES for 2-(ethylamino)-N-(1,2-oxazol-3-yl)pyrimidine-5-sulfonamide is CCNc1ncc(S(=O)(=O)Nc2ccon2)cn1.
What is the InChIKey of 2-(ethylamino)-N-(1,2-oxazol-3-yl)pyrimidine-5-sulfonamide?
The InChIKey is AOSZJASGYFGIHB-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11N5O3S/c1-2-10-9-11-5-7(6-12-9)18(15,16)14-8-3-4-17-13-8/h3-6H,2H2,1H3,(H,13,14)(H,10,11,12).
What are the key properties of 2-(ethylamino)-N-(1,2-oxazol-3-yl)pyrimidine-5-sulfonamide?
2-(ethylamino)-N-(1,2-oxazol-3-yl)pyrimidine-5-sulfonamide has a molecular weight of 269.29 g/mol, XLogP of 0.70, 5 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(ethylamino)-N-(1,2-oxazol-3-yl)pyrimidine-5-sulfonamide is sourced from PubChem (CID 62902362), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).