2-[(3-amino-4-pyridinyl)sulfonyl]-1-morpholin-4-ylethanone

C11H15N3O4S — CID 62113459

IUPAC2-[(3-amino-4-pyridinyl)sulfonyl]-1-morpholin-4-ylethanone
SMILESNc1cnccc1S(=O)(=O)CC(=O)N1CCOCC1
InChIInChI=1S/C11H15N3O4S/c12-9-7-13-2-1-10(9)19(16,17)8-11(15)14-3-5-18-6-4-14/h1-2,7H,3-6,8,12H2
InChIKeyLLQFPAUJULUPBO-UHFFFAOYSA-N
MW285.32 g/mol
LogP-0.70
Rot. Bonds3

About 2-[(3-amino-4-pyridinyl)sulfonyl]-1-morpholin-4-ylethanone

2-[(3-amino-4-pyridinyl)sulfonyl]-1-morpholin-4-ylethanone (PubChem CID 62113459) has the molecular formula C11H15N3O4S and a molecular weight of 285.32 g/mol. Its IUPAC name is 2-[(3-amino-4-pyridinyl)sulfonyl]-1-morpholin-4-ylethanone.

Molecular Properties

Compound Name2-[(3-amino-4-pyridinyl)sulfonyl]-1-morpholin-4-ylethanone
PubChem CID62113459
Molecular FormulaC11H15N3O4S
Molecular Weight285.32 g/mol
Exact Mass285.08
IUPAC Name2-[(3-amino-4-pyridinyl)sulfonyl]-1-morpholin-4-ylethanone
SMILESNc1cnccc1S(=O)(=O)CC(=O)N1CCOCC1
InChIInChI=1S/C11H15N3O4S/c12-9-7-13-2-1-10(9)19(16,17)8-11(15)14-3-5-18-6-4-14/h1-2,7H,3-6,8,12H2
InChIKeyLLQFPAUJULUPBO-UHFFFAOYSA-N
XLogP-0.70
TPSA102.59 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.32
LogP ≤ 5-0.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

2-(2-amino-4-chlorophenyl)sulfonyl-1-morpholin-4-ylethanone
CID 81175966
2-(4-fluorophenyl)sulfonyl-1-morpholin-4-ylethanone
CID 1486407
2-[(3-amino-4-pyridinyl)sulfonyl]-N-cycloheptylacetamide
CID 62575123
2-(2-aminophenyl)sulfonyl-1-(4-methylpiperazin-1-yl)ethanone
CID 61367606
2-[(3-amino-4-pyridinyl)sulfonyl]-1-pyrrolidin-1-ylpropan-1-one
CID 62113460
4-(2-fluoroethylsulfonyl)pyridin-3-amine
CID 80694965
3-[(3-chloro-4-pyridinyl)amino]-1-morpholin-4-ylpropan-1-one
CID 112697162
4-(3-amino-4-pyridinyl)-N-(2-methyl-2-morpholin-4-ylpropyl)benzamide
CID 122572179
4-chloro-N-(3-morpholin-4-yl-3-oxopropyl)pyridine-3-carboxamide
CID 115868328
3-[(3-amino-4-pyridinyl)sulfonylmethyl]-4-fluorobenzamide
CID 62113980
4-amino-2-[4-(2-morpholin-4-yl-2-oxoethyl)sulfonylphenyl]thieno[3,2-c]pyridine-7-carboxamide
CID 23585501
2-[(3-amino-4-pyridinyl)sulfanyl]-1-(azocan-1-yl)ethanone
CID 43299913

Frequently Asked Questions

What is the IUPAC name of 2-[(3-amino-4-pyridinyl)sulfonyl]-1-morpholin-4-ylethanone?
The IUPAC name of 2-[(3-amino-4-pyridinyl)sulfonyl]-1-morpholin-4-ylethanone (CID 62113459) is 2-[(3-amino-4-pyridinyl)sulfonyl]-1-morpholin-4-ylethanone.
What is the SMILES notation for 2-[(3-amino-4-pyridinyl)sulfonyl]-1-morpholin-4-ylethanone?
The canonical SMILES for 2-[(3-amino-4-pyridinyl)sulfonyl]-1-morpholin-4-ylethanone is Nc1cnccc1S(=O)(=O)CC(=O)N1CCOCC1.
What is the InChIKey of 2-[(3-amino-4-pyridinyl)sulfonyl]-1-morpholin-4-ylethanone?
The InChIKey is LLQFPAUJULUPBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3O4S/c12-9-7-13-2-1-10(9)19(16,17)8-11(15)14-3-5-18-6-4-14/h1-2,7H,3-6,8,12H2.
What are the key properties of 2-[(3-amino-4-pyridinyl)sulfonyl]-1-morpholin-4-ylethanone?
2-[(3-amino-4-pyridinyl)sulfonyl]-1-morpholin-4-ylethanone has a molecular weight of 285.32 g/mol, XLogP of -0.70, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3-amino-4-pyridinyl)sulfonyl]-1-morpholin-4-ylethanone is sourced from PubChem (CID 62113459), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).