4-[(6-morpholin-4-yl-3-pyridinyl)sulfonyl]piperazine-2-carboxylic acid

C14H20N4O5S — CID 56876762

IUPAC4-[(6-morpholin-4-yl-3-pyridinyl)sulfonyl]piperazine-2-carboxylic acid
SMILESO=C(O)C1CN(S(=O)(=O)c2ccc(N3CCOCC3)nc2)CCN1
InChIInChI=1S/C14H20N4O5S/c19-14(20)12-10-18(4-3-15-12)24(21,22)11-1-2-13(16-9-11)17-5-7-23-8-6-17/h1-2,9,12,15H,3-8,10H2,(H,19,20)
InChIKeyRYUVBVLNBBQJJA-UHFFFAOYSA-N
MW356.40 g/mol
LogP-1.03
Rot. Bonds4

About 4-[(6-morpholin-4-yl-3-pyridinyl)sulfonyl]piperazine-2-carboxylic acid

4-[(6-morpholin-4-yl-3-pyridinyl)sulfonyl]piperazine-2-carboxylic acid (PubChem CID 56876762) has the molecular formula C14H20N4O5S and a molecular weight of 356.40 g/mol. Its IUPAC name is 4-[(6-morpholin-4-yl-3-pyridinyl)sulfonyl]piperazine-2-carboxylic acid.

Molecular Properties

Compound Name4-[(6-morpholin-4-yl-3-pyridinyl)sulfonyl]piperazine-2-carboxylic acid
PubChem CID56876762
Molecular FormulaC14H20N4O5S
Molecular Weight356.40 g/mol
Exact Mass356.12
IUPAC Name4-[(6-morpholin-4-yl-3-pyridinyl)sulfonyl]piperazine-2-carboxylic acid
SMILESO=C(O)C1CN(S(=O)(=O)c2ccc(N3CCOCC3)nc2)CCN1
InChIInChI=1S/C14H20N4O5S/c19-14(20)12-10-18(4-3-15-12)24(21,22)11-1-2-13(16-9-11)17-5-7-23-8-6-17/h1-2,9,12,15H,3-8,10H2,(H,19,20)
InChIKeyRYUVBVLNBBQJJA-UHFFFAOYSA-N
XLogP-1.03
TPSA112.07 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.40
LogP ≤ 5-1.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Analyze 4-[(6-morpholin-4-yl-3-pyridinyl)sulfonyl]piperazine-2-carboxylic acid with MolForge

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Related Compounds

N-[1-[(6-morpholin-4-yl-3-pyridinyl)sulfonyl]azepan-3-yl]prop-2-enamide
CID 89236153
4-(6-morpholin-4-ylpyrimidin-4-yl)piperazine-2-carboxylic acid
CID 56877905
(2S,6R)-2,6-dimethyl-4-(5-morpholin-4-ylsulfonyl-2-pyridinyl)morpholine
CID 7042964
2-[4-(5-morpholin-4-ylsulfonyl-2-pyridinyl)piperazin-1-yl]phenol
CID 9282198
2-methylsulfanyl-1-[4-(5-morpholin-4-ylsulfonyl-2-pyridinyl)piperazin-1-yl]ethanone
CID 24633618
1-(5-piperidin-1-ylsulfonyl-2-pyridinyl)azetidine-3-carboxylic acid
CID 122064558
(2S)-4-(4-butan-2-ylphenyl)sulfonylpiperazine-2-carboxylic acid
CID 136588996
4-[[6-[3-(azepan-1-yl)piperidin-1-yl]-3-pyridinyl]sulfonyl]morpholine
CID 133454493
N-(5-methyl-1,2-oxazol-3-yl)-4-(5-morpholin-4-ylsulfonyl-2-pyridinyl)piperazine-1-carboxamide
CID 24612405
N-methyl-1-[(6-morpholin-4-yl-3-pyridinyl)sulfonyl]-N-(2-phenylethyl)piperidin-4-amine
CID 166097427
[4-[(6-morpholin-4-yl-3-pyridinyl)sulfonylamino]cyclohexyl]carbamic acid
CID 174214991
2-(4-methylphenyl)-1-[4-(5-morpholin-4-ylsulfonyl-2-pyridinyl)piperazin-1-yl]ethanone
CID 24598564

Frequently Asked Questions

What is the IUPAC name of 4-[(6-morpholin-4-yl-3-pyridinyl)sulfonyl]piperazine-2-carboxylic acid?
The IUPAC name of 4-[(6-morpholin-4-yl-3-pyridinyl)sulfonyl]piperazine-2-carboxylic acid (CID 56876762) is 4-[(6-morpholin-4-yl-3-pyridinyl)sulfonyl]piperazine-2-carboxylic acid.
What is the SMILES notation for 4-[(6-morpholin-4-yl-3-pyridinyl)sulfonyl]piperazine-2-carboxylic acid?
The canonical SMILES for 4-[(6-morpholin-4-yl-3-pyridinyl)sulfonyl]piperazine-2-carboxylic acid is O=C(O)C1CN(S(=O)(=O)c2ccc(N3CCOCC3)nc2)CCN1.
What is the InChIKey of 4-[(6-morpholin-4-yl-3-pyridinyl)sulfonyl]piperazine-2-carboxylic acid?
The InChIKey is RYUVBVLNBBQJJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N4O5S/c19-14(20)12-10-18(4-3-15-12)24(21,22)11-1-2-13(16-9-11)17-5-7-23-8-6-17/h1-2,9,12,15H,3-8,10H2,(H,19,20).
What are the key properties of 4-[(6-morpholin-4-yl-3-pyridinyl)sulfonyl]piperazine-2-carboxylic acid?
4-[(6-morpholin-4-yl-3-pyridinyl)sulfonyl]piperazine-2-carboxylic acid has a molecular weight of 356.40 g/mol, XLogP of -1.03, 4 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(6-morpholin-4-yl-3-pyridinyl)sulfonyl]piperazine-2-carboxylic acid is sourced from PubChem (CID 56876762), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).