2-(ethylamino)-N-pyrazin-2-ylpyrimidine-5-sulfonamide

C10H12N6O2S — CID 62148086

IUPAC2-(ethylamino)-N-pyrazin-2-ylpyrimidine-5-sulfonamide
SMILESCCNc1ncc(S(=O)(=O)Nc2cnccn2)cn1
InChIInChI=1S/C10H12N6O2S/c1-2-12-10-14-5-8(6-15-10)19(17,18)16-9-7-11-3-4-13-9/h3-7H,2H2,1H3,(H,13,16)(H,12,14,15)
InChIKeySQPMBRWLUWYSIP-UHFFFAOYSA-N
MW280.31 g/mol
LogP0.50
Rot. Bonds5

About 2-(ethylamino)-N-pyrazin-2-ylpyrimidine-5-sulfonamide

2-(ethylamino)-N-pyrazin-2-ylpyrimidine-5-sulfonamide (PubChem CID 62148086) has the molecular formula C10H12N6O2S and a molecular weight of 280.31 g/mol. Its IUPAC name is 2-(ethylamino)-N-pyrazin-2-ylpyrimidine-5-sulfonamide.

Molecular Properties

Compound Name2-(ethylamino)-N-pyrazin-2-ylpyrimidine-5-sulfonamide
PubChem CID62148086
Molecular FormulaC10H12N6O2S
Molecular Weight280.31 g/mol
Exact Mass280.07
IUPAC Name2-(ethylamino)-N-pyrazin-2-ylpyrimidine-5-sulfonamide
SMILESCCNc1ncc(S(=O)(=O)Nc2cnccn2)cn1
InChIInChI=1S/C10H12N6O2S/c1-2-12-10-14-5-8(6-15-10)19(17,18)16-9-7-11-3-4-13-9/h3-7H,2H2,1H3,(H,13,16)(H,12,14,15)
InChIKeySQPMBRWLUWYSIP-UHFFFAOYSA-N
XLogP0.50
TPSA109.76 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.31
LogP ≤ 50.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 2-(ethylamino)-N-pyrazin-2-ylpyrimidine-5-sulfonamide?
The IUPAC name of 2-(ethylamino)-N-pyrazin-2-ylpyrimidine-5-sulfonamide (CID 62148086) is 2-(ethylamino)-N-pyrazin-2-ylpyrimidine-5-sulfonamide.
What is the SMILES notation for 2-(ethylamino)-N-pyrazin-2-ylpyrimidine-5-sulfonamide?
The canonical SMILES for 2-(ethylamino)-N-pyrazin-2-ylpyrimidine-5-sulfonamide is CCNc1ncc(S(=O)(=O)Nc2cnccn2)cn1.
What is the InChIKey of 2-(ethylamino)-N-pyrazin-2-ylpyrimidine-5-sulfonamide?
The InChIKey is SQPMBRWLUWYSIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N6O2S/c1-2-12-10-14-5-8(6-15-10)19(17,18)16-9-7-11-3-4-13-9/h3-7H,2H2,1H3,(H,13,16)(H,12,14,15).
What are the key properties of 2-(ethylamino)-N-pyrazin-2-ylpyrimidine-5-sulfonamide?
2-(ethylamino)-N-pyrazin-2-ylpyrimidine-5-sulfonamide has a molecular weight of 280.31 g/mol, XLogP of 0.50, 5 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(ethylamino)-N-pyrazin-2-ylpyrimidine-5-sulfonamide is sourced from PubChem (CID 62148086), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).