2-[(6-amino-2-propylpyrimidin-4-yl)amino]-N-methylethanesulfonamide

C10H19N5O2S — CID 106343133

IUPAC2-[(6-amino-2-propylpyrimidin-4-yl)amino]-N-methylethanesulfonamide
SMILESCCCc1nc(N)cc(NCCS(=O)(=O)NC)n1
InChIInChI=1S/C10H19N5O2S/c1-3-4-9-14-8(11)7-10(15-9)13-5-6-18(16,17)12-2/h7,12H,3-6H2,1-2H3,(H3,11,13,14,15)
InChIKeyZLMKPXSXBZWHES-UHFFFAOYSA-N
MW273.36 g/mol
LogP-0.03
Rot. Bonds7

About 2-[(6-amino-2-propylpyrimidin-4-yl)amino]-N-methylethanesulfonamide

2-[(6-amino-2-propylpyrimidin-4-yl)amino]-N-methylethanesulfonamide (PubChem CID 106343133) has the molecular formula C10H19N5O2S and a molecular weight of 273.36 g/mol. Its IUPAC name is 2-[(6-amino-2-propylpyrimidin-4-yl)amino]-N-methylethanesulfonamide.

Molecular Properties

Compound Name2-[(6-amino-2-propylpyrimidin-4-yl)amino]-N-methylethanesulfonamide
PubChem CID106343133
Molecular FormulaC10H19N5O2S
Molecular Weight273.36 g/mol
Exact Mass273.13
IUPAC Name2-[(6-amino-2-propylpyrimidin-4-yl)amino]-N-methylethanesulfonamide
SMILESCCCc1nc(N)cc(NCCS(=O)(=O)NC)n1
InChIInChI=1S/C10H19N5O2S/c1-3-4-9-14-8(11)7-10(15-9)13-5-6-18(16,17)12-2/h7,12H,3-6H2,1-2H3,(H3,11,13,14,15)
InChIKeyZLMKPXSXBZWHES-UHFFFAOYSA-N
XLogP-0.03
TPSA110.00 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.36
LogP ≤ 5-0.03
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

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Related Compounds

N-ethyl-2-[[6-(methylamino)-2-propylpyrimidin-4-yl]amino]ethanesulfonamide
CID 106343405
2-[(6-amino-2-cyclopropylpyrimidin-4-yl)amino]-N-methylethanesulfonamide
CID 114176051
4-N-decyl-2-propylpyrimidine-4,6-diamine
CID 80943780
3-[(6-amino-2-propylpyrimidin-4-yl)amino]propan-1-ol
CID 80954273
3-[(6-amino-2-propylpyrimidin-4-yl)amino]-N-propylpropanamide
CID 80954256
2-[(6-amino-2-ethylpyrimidin-4-yl)amino]ethanesulfonamide
CID 80934040
2-[(6-amino-2-propylpyrimidin-4-yl)amino]ethylurea
CID 83118298
2-[(2-ethyl-6-methylpyrimidin-4-yl)amino]-N-methylethanesulfonamide
CID 114276539
4-N-(3-ethoxypropyl)-2-propylpyrimidine-4,6-diamine
CID 80946334
6-hydrazinyl-2-propylpyrimidin-4-amine
CID 80947336
2-[(6-aminopyrazin-2-yl)amino]-N-methylethanesulfonamide
CID 106343062
2-ethyl-4-N-(3-methylsulfonylpropyl)pyrimidine-4,6-diamine
CID 80934736

Frequently Asked Questions

What is the IUPAC name of 2-[(6-amino-2-propylpyrimidin-4-yl)amino]-N-methylethanesulfonamide?
The IUPAC name of 2-[(6-amino-2-propylpyrimidin-4-yl)amino]-N-methylethanesulfonamide (CID 106343133) is 2-[(6-amino-2-propylpyrimidin-4-yl)amino]-N-methylethanesulfonamide.
What is the SMILES notation for 2-[(6-amino-2-propylpyrimidin-4-yl)amino]-N-methylethanesulfonamide?
The canonical SMILES for 2-[(6-amino-2-propylpyrimidin-4-yl)amino]-N-methylethanesulfonamide is CCCc1nc(N)cc(NCCS(=O)(=O)NC)n1.
What is the InChIKey of 2-[(6-amino-2-propylpyrimidin-4-yl)amino]-N-methylethanesulfonamide?
The InChIKey is ZLMKPXSXBZWHES-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N5O2S/c1-3-4-9-14-8(11)7-10(15-9)13-5-6-18(16,17)12-2/h7,12H,3-6H2,1-2H3,(H3,11,13,14,15).
What are the key properties of 2-[(6-amino-2-propylpyrimidin-4-yl)amino]-N-methylethanesulfonamide?
2-[(6-amino-2-propylpyrimidin-4-yl)amino]-N-methylethanesulfonamide has a molecular weight of 273.36 g/mol, XLogP of -0.03, 7 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(6-amino-2-propylpyrimidin-4-yl)amino]-N-methylethanesulfonamide is sourced from PubChem (CID 106343133), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).