4-[[2-(aminomethyl)-3-pyridinyl]sulfonyl]morpholine-3-carboxamide

C11H16N4O4S — CID 106594820

IUPAC4-[[2-(aminomethyl)-3-pyridinyl]sulfonyl]morpholine-3-carboxamide
SMILESNCc1ncccc1S(=O)(=O)N1CCOCC1C(N)=O
InChIInChI=1S/C11H16N4O4S/c12-6-8-10(2-1-3-14-8)20(17,18)15-4-5-19-7-9(15)11(13)16/h1-3,9H,4-7,12H2,(H2,13,16)
InChIKeyDRECVIZIDNMRRT-UHFFFAOYSA-N
MW300.34 g/mol
LogP-1.58
Rot. Bonds4

About 4-[[2-(aminomethyl)-3-pyridinyl]sulfonyl]morpholine-3-carboxamide

4-[[2-(aminomethyl)-3-pyridinyl]sulfonyl]morpholine-3-carboxamide (PubChem CID 106594820) has the molecular formula C11H16N4O4S and a molecular weight of 300.34 g/mol. Its IUPAC name is 4-[[2-(aminomethyl)-3-pyridinyl]sulfonyl]morpholine-3-carboxamide.

Molecular Properties

Compound Name4-[[2-(aminomethyl)-3-pyridinyl]sulfonyl]morpholine-3-carboxamide
PubChem CID106594820
Molecular FormulaC11H16N4O4S
Molecular Weight300.34 g/mol
Exact Mass300.09
IUPAC Name4-[[2-(aminomethyl)-3-pyridinyl]sulfonyl]morpholine-3-carboxamide
SMILESNCc1ncccc1S(=O)(=O)N1CCOCC1C(N)=O
InChIInChI=1S/C11H16N4O4S/c12-6-8-10(2-1-3-14-8)20(17,18)15-4-5-19-7-9(15)11(13)16/h1-3,9H,4-7,12H2,(H2,13,16)
InChIKeyDRECVIZIDNMRRT-UHFFFAOYSA-N
XLogP-1.58
TPSA128.61 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.34
LogP ≤ 5-1.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

4-[(2-amino-3-pyridinyl)sulfonyl]-N-ethylmorpholine-3-carboxamide
CID 83096793
4-(2-amino-3-fluorophenyl)sulfonylmorpholine-3-carboxamide
CID 83094650
(3R)-4-(4-fluorophenyl)sulfonylmorpholine-3-carboxamide
CID 71193250
(3-pyrrolidin-1-ylsulfonyl-2-pyridinyl)methanamine
CID 106593652
4-(2-bromo-4-fluorophenyl)sulfonylmorpholine-3-carboxamide
CID 83092795
4-(3-amino-1-propylpyrazol-4-yl)sulfonylmorpholine-3-carboxamide
CID 83093925
4-[(2-methyl-1H-imidazol-5-yl)sulfonyl]morpholine-3-carboxamide
CID 83096595
5-bromo-4-(3-carbamoylmorpholin-4-yl)sulfonylfuran-2-carboxylic acid
CID 83096729
4-(5-amino-2-fluoro-4-methylphenyl)sulfonylmorpholine-3-carboxamide
CID 83093926
1-[(2-chloro-3-pyridinyl)sulfonyl]piperidine-2-carboxamide
CID 54980224
4-[(2-methylphenyl)methylsulfonyl]morpholine-3-carboxamide
CID 136520750
4-(3-carbamoylmorpholin-4-yl)sulfonylthiophene-2-carboxylic acid
CID 83101664

Frequently Asked Questions

What is the IUPAC name of 4-[[2-(aminomethyl)-3-pyridinyl]sulfonyl]morpholine-3-carboxamide?
The IUPAC name of 4-[[2-(aminomethyl)-3-pyridinyl]sulfonyl]morpholine-3-carboxamide (CID 106594820) is 4-[[2-(aminomethyl)-3-pyridinyl]sulfonyl]morpholine-3-carboxamide.
What is the SMILES notation for 4-[[2-(aminomethyl)-3-pyridinyl]sulfonyl]morpholine-3-carboxamide?
The canonical SMILES for 4-[[2-(aminomethyl)-3-pyridinyl]sulfonyl]morpholine-3-carboxamide is NCc1ncccc1S(=O)(=O)N1CCOCC1C(N)=O.
What is the InChIKey of 4-[[2-(aminomethyl)-3-pyridinyl]sulfonyl]morpholine-3-carboxamide?
The InChIKey is DRECVIZIDNMRRT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N4O4S/c12-6-8-10(2-1-3-14-8)20(17,18)15-4-5-19-7-9(15)11(13)16/h1-3,9H,4-7,12H2,(H2,13,16).
What are the key properties of 4-[[2-(aminomethyl)-3-pyridinyl]sulfonyl]morpholine-3-carboxamide?
4-[[2-(aminomethyl)-3-pyridinyl]sulfonyl]morpholine-3-carboxamide has a molecular weight of 300.34 g/mol, XLogP of -1.58, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[2-(aminomethyl)-3-pyridinyl]sulfonyl]morpholine-3-carboxamide is sourced from PubChem (CID 106594820), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).