2-[(2-amino-5-bromo-3-pyridinyl)sulfonylamino]-2-methylpropanamide

C9H13BrN4O3S — CID 62152954

IUPAC2-[(2-amino-5-bromo-3-pyridinyl)sulfonylamino]-2-methylpropanamide
SMILESCC(C)(NS(=O)(=O)c1cc(Br)cnc1N)C(N)=O
InChIInChI=1S/C9H13BrN4O3S/c1-9(2,8(12)15)14-18(16,17)6-3-5(10)4-13-7(6)11/h3-4,14H,1-2H3,(H2,11,13)(H2,12,15)
InChIKeyPQQDKMXBHPFPTI-UHFFFAOYSA-N
MW337.20 g/mol
LogP-0.03
Rot. Bonds4

About 2-[(2-amino-5-bromo-3-pyridinyl)sulfonylamino]-2-methylpropanamide

2-[(2-amino-5-bromo-3-pyridinyl)sulfonylamino]-2-methylpropanamide (PubChem CID 62152954) has the molecular formula C9H13BrN4O3S and a molecular weight of 337.20 g/mol. Its IUPAC name is 2-[(2-amino-5-bromo-3-pyridinyl)sulfonylamino]-2-methylpropanamide.

Molecular Properties

Compound Name2-[(2-amino-5-bromo-3-pyridinyl)sulfonylamino]-2-methylpropanamide
PubChem CID62152954
Molecular FormulaC9H13BrN4O3S
Molecular Weight337.20 g/mol
Exact Mass335.99
IUPAC Name2-[(2-amino-5-bromo-3-pyridinyl)sulfonylamino]-2-methylpropanamide
SMILESCC(C)(NS(=O)(=O)c1cc(Br)cnc1N)C(N)=O
InChIInChI=1S/C9H13BrN4O3S/c1-9(2,8(12)15)14-18(16,17)6-3-5(10)4-13-7(6)11/h3-4,14H,1-2H3,(H2,11,13)(H2,12,15)
InChIKeyPQQDKMXBHPFPTI-UHFFFAOYSA-N
XLogP-0.03
TPSA128.17 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.20
LogP ≤ 5-0.03
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

2-[(6-amino-5-chloro-3-pyridinyl)sulfonylamino]-2-methylpropanamide
CID 64601109
2-amino-5-bromo-N-(3,3-dimethylbutan-2-yl)pyridine-3-sulfonamide
CID 115748656
2-amino-5-bromo-N-(4-bromo-2,6-dimethylphenyl)pyridine-3-sulfonamide
CID 62163149
2-amino-5-bromo-N-(2,6-dimethylphenyl)pyridine-3-sulfonamide
CID 22515848
3-[2-[(2-amino-5-bromo-3-pyridinyl)sulfonylamino]ethyl]-1,1-dimethylurea
CID 83114587
2-[(2-amino-5-bromo-3-pyridinyl)sulfonylamino]-N-ethylpropanamide
CID 62153701
2-amino-5-bromopyridine-3-sulfonyl chloride
CID 53302026
3-[(2-amino-5-bromo-3-pyridinyl)sulfonylamino]-N-propylpropanamide
CID 46272034
N-(3-acetylphenyl)-2-amino-5-bromopyridine-3-sulfonamide
CID 22515885
2-amino-5-bromo-N-(4,4,4-trifluorobutan-2-yl)pyridine-3-sulfonamide
CID 104854801
2-amino-5-bromo-N-[(1-propylcyclopropyl)methyl]pyridine-3-sulfonamide
CID 103823892
2-amino-5-bromo-N-[2-(diethylamino)ethyl]pyridine-3-sulfonamide
CID 22515875

Frequently Asked Questions

What is the IUPAC name of 2-[(2-amino-5-bromo-3-pyridinyl)sulfonylamino]-2-methylpropanamide?
The IUPAC name of 2-[(2-amino-5-bromo-3-pyridinyl)sulfonylamino]-2-methylpropanamide (CID 62152954) is 2-[(2-amino-5-bromo-3-pyridinyl)sulfonylamino]-2-methylpropanamide.
What is the SMILES notation for 2-[(2-amino-5-bromo-3-pyridinyl)sulfonylamino]-2-methylpropanamide?
The canonical SMILES for 2-[(2-amino-5-bromo-3-pyridinyl)sulfonylamino]-2-methylpropanamide is CC(C)(NS(=O)(=O)c1cc(Br)cnc1N)C(N)=O.
What is the InChIKey of 2-[(2-amino-5-bromo-3-pyridinyl)sulfonylamino]-2-methylpropanamide?
The InChIKey is PQQDKMXBHPFPTI-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13BrN4O3S/c1-9(2,8(12)15)14-18(16,17)6-3-5(10)4-13-7(6)11/h3-4,14H,1-2H3,(H2,11,13)(H2,12,15).
What are the key properties of 2-[(2-amino-5-bromo-3-pyridinyl)sulfonylamino]-2-methylpropanamide?
2-[(2-amino-5-bromo-3-pyridinyl)sulfonylamino]-2-methylpropanamide has a molecular weight of 337.20 g/mol, XLogP of -0.03, 4 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-amino-5-bromo-3-pyridinyl)sulfonylamino]-2-methylpropanamide is sourced from PubChem (CID 62152954), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).