2-amino-N-(2-methylpentan-2-yl)pyrimidine-5-sulfonamide

C10H18N4O2S — CID 113471995

IUPAC2-amino-N-(2-methylpentan-2-yl)pyrimidine-5-sulfonamide
SMILESCCCC(C)(C)NS(=O)(=O)c1cnc(N)nc1
InChIInChI=1S/C10H18N4O2S/c1-4-5-10(2,3)14-17(15,16)8-6-12-9(11)13-7-8/h6-7,14H,4-5H2,1-3H3,(H2,11,12,13)
InChIKeyLNMCBZZKHSFQGB-UHFFFAOYSA-N
MW258.35 g/mol
LogP0.92
Rot. Bonds5

About 2-amino-N-(2-methylpentan-2-yl)pyrimidine-5-sulfonamide

2-amino-N-(2-methylpentan-2-yl)pyrimidine-5-sulfonamide (PubChem CID 113471995) has the molecular formula C10H18N4O2S and a molecular weight of 258.35 g/mol. Its IUPAC name is 2-amino-N-(2-methylpentan-2-yl)pyrimidine-5-sulfonamide.

Molecular Properties

Compound Name2-amino-N-(2-methylpentan-2-yl)pyrimidine-5-sulfonamide
PubChem CID113471995
Molecular FormulaC10H18N4O2S
Molecular Weight258.35 g/mol
Exact Mass258.12
IUPAC Name2-amino-N-(2-methylpentan-2-yl)pyrimidine-5-sulfonamide
SMILESCCCC(C)(C)NS(=O)(=O)c1cnc(N)nc1
InChIInChI=1S/C10H18N4O2S/c1-4-5-10(2,3)14-17(15,16)8-6-12-9(11)13-7-8/h6-7,14H,4-5H2,1-3H3,(H2,11,12,13)
InChIKeyLNMCBZZKHSFQGB-UHFFFAOYSA-N
XLogP0.92
TPSA97.97 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.35
LogP ≤ 50.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-amino-N-tert-butylpyrimidine-5-sulfonamide
CID 62148276
2-amino-N-ethylpyrimidine-5-sulfonamide
CID 62148318
4-amino-3-fluoro-N-(2-methylpentan-2-yl)benzenesulfonamide
CID 113471557
4-acetyl-N-(2-methylpentan-2-yl)benzenesulfonamide
CID 49460708
2-amino-N-propan-2-ylpyrimidine-5-sulfonamide
CID 62150881
2-amino-N-octan-4-ylpyrimidine-5-sulfonamide
CID 106027708
2-amino-N-(2-methylsulfonylethyl)pyrimidine-5-sulfonamide
CID 62162959
2-amino-N-(4-ethylphenyl)pyrimidine-5-sulfonamide
CID 62142790
5,6-dichloro-N-(2-methylbutan-2-yl)pyridine-3-sulfonamide
CID 64624600
2-amino-N-[2-(dimethylamino)ethyl]pyrimidine-5-sulfonamide
CID 62149164
N-(2-methylpentan-2-yl)naphthalene-1-sulfonamide
CID 115684135
2-amino-N-(2-methoxypropyl)pyrimidine-5-sulfonamide
CID 102700480

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(2-methylpentan-2-yl)pyrimidine-5-sulfonamide?
The IUPAC name of 2-amino-N-(2-methylpentan-2-yl)pyrimidine-5-sulfonamide (CID 113471995) is 2-amino-N-(2-methylpentan-2-yl)pyrimidine-5-sulfonamide.
What is the SMILES notation for 2-amino-N-(2-methylpentan-2-yl)pyrimidine-5-sulfonamide?
The canonical SMILES for 2-amino-N-(2-methylpentan-2-yl)pyrimidine-5-sulfonamide is CCCC(C)(C)NS(=O)(=O)c1cnc(N)nc1.
What is the InChIKey of 2-amino-N-(2-methylpentan-2-yl)pyrimidine-5-sulfonamide?
The InChIKey is LNMCBZZKHSFQGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N4O2S/c1-4-5-10(2,3)14-17(15,16)8-6-12-9(11)13-7-8/h6-7,14H,4-5H2,1-3H3,(H2,11,12,13).
What are the key properties of 2-amino-N-(2-methylpentan-2-yl)pyrimidine-5-sulfonamide?
2-amino-N-(2-methylpentan-2-yl)pyrimidine-5-sulfonamide has a molecular weight of 258.35 g/mol, XLogP of 0.92, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(2-methylpentan-2-yl)pyrimidine-5-sulfonamide is sourced from PubChem (CID 113471995), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).