2-amino-N-(2-methoxyethyl)-N-methylpyrimidine-5-sulfonamide

C8H14N4O3S — CID 62152411

IUPAC2-amino-N-(2-methoxyethyl)-N-methylpyrimidine-5-sulfonamide
SMILESCOCCN(C)S(=O)(=O)c1cnc(N)nc1
InChIInChI=1S/C8H14N4O3S/c1-12(3-4-15-2)16(13,14)7-5-10-8(9)11-6-7/h5-6H,3-4H2,1-2H3,(H2,9,10,11)
InChIKeyUOVNDOZMOYUTCL-UHFFFAOYSA-N
MW246.29 g/mol
LogP-0.67
Rot. Bonds5

About 2-amino-N-(2-methoxyethyl)-N-methylpyrimidine-5-sulfonamide

2-amino-N-(2-methoxyethyl)-N-methylpyrimidine-5-sulfonamide (PubChem CID 62152411) has the molecular formula C8H14N4O3S and a molecular weight of 246.29 g/mol. Its IUPAC name is 2-amino-N-(2-methoxyethyl)-N-methylpyrimidine-5-sulfonamide.

Molecular Properties

Compound Name2-amino-N-(2-methoxyethyl)-N-methylpyrimidine-5-sulfonamide
PubChem CID62152411
Molecular FormulaC8H14N4O3S
Molecular Weight246.29 g/mol
Exact Mass246.08
IUPAC Name2-amino-N-(2-methoxyethyl)-N-methylpyrimidine-5-sulfonamide
SMILESCOCCN(C)S(=O)(=O)c1cnc(N)nc1
InChIInChI=1S/C8H14N4O3S/c1-12(3-4-15-2)16(13,14)7-5-10-8(9)11-6-7/h5-6H,3-4H2,1-2H3,(H2,9,10,11)
InChIKeyUOVNDOZMOYUTCL-UHFFFAOYSA-N
XLogP-0.67
TPSA98.41 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.29
LogP ≤ 5-0.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(2-methoxyethyl)-N-methylpyrimidine-5-sulfonamide?
The IUPAC name of 2-amino-N-(2-methoxyethyl)-N-methylpyrimidine-5-sulfonamide (CID 62152411) is 2-amino-N-(2-methoxyethyl)-N-methylpyrimidine-5-sulfonamide.
What is the SMILES notation for 2-amino-N-(2-methoxyethyl)-N-methylpyrimidine-5-sulfonamide?
The canonical SMILES for 2-amino-N-(2-methoxyethyl)-N-methylpyrimidine-5-sulfonamide is COCCN(C)S(=O)(=O)c1cnc(N)nc1.
What is the InChIKey of 2-amino-N-(2-methoxyethyl)-N-methylpyrimidine-5-sulfonamide?
The InChIKey is UOVNDOZMOYUTCL-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N4O3S/c1-12(3-4-15-2)16(13,14)7-5-10-8(9)11-6-7/h5-6H,3-4H2,1-2H3,(H2,9,10,11).
What are the key properties of 2-amino-N-(2-methoxyethyl)-N-methylpyrimidine-5-sulfonamide?
2-amino-N-(2-methoxyethyl)-N-methylpyrimidine-5-sulfonamide has a molecular weight of 246.29 g/mol, XLogP of -0.67, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(2-methoxyethyl)-N-methylpyrimidine-5-sulfonamide is sourced from PubChem (CID 62152411), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).