3-[[(2R,6S)-2,6-dimethylmorpholin-4-yl]sulfonylamino]-N-(5-methyl-2-pyridinyl)propanamide

C15H24N4O4S — CID 52518103

IUPAC3-[[(2R,6S)-2,6-dimethylmorpholin-4-yl]sulfonylamino]-N-(5-methyl-2-pyridinyl)propanamide
SMILESCc1ccc(NC(=O)CCNS(=O)(=O)N2C[C@@H](C)O[C@@H](C)C2)nc1
InChIInChI=1S/C15H24N4O4S/c1-11-4-5-14(16-8-11)18-15(20)6-7-17-24(21,22)19-9-12(2)23-13(3)10-19/h4-5,8,12-13,17H,6-7,9-10H2,1-3H3,(H,16,18,20)/t12-,13+
InChIKeyKNYBOIZQNRPQAP-BETUJISGSA-N
MW356.45 g/mol
LogP0.66
Rot. Bonds6

About 3-[[(2R,6S)-2,6-dimethylmorpholin-4-yl]sulfonylamino]-N-(5-methyl-2-pyridinyl)propanamide

3-[[(2R,6S)-2,6-dimethylmorpholin-4-yl]sulfonylamino]-N-(5-methyl-2-pyridinyl)propanamide (PubChem CID 52518103) has the molecular formula C15H24N4O4S and a molecular weight of 356.45 g/mol. Its IUPAC name is 3-[[(2R,6S)-2,6-dimethylmorpholin-4-yl]sulfonylamino]-N-(5-methyl-2-pyridinyl)propanamide.

Molecular Properties

Compound Name3-[[(2R,6S)-2,6-dimethylmorpholin-4-yl]sulfonylamino]-N-(5-methyl-2-pyridinyl)propanamide
PubChem CID52518103
Molecular FormulaC15H24N4O4S
Molecular Weight356.45 g/mol
Exact Mass356.15
IUPAC Name3-[[(2R,6S)-2,6-dimethylmorpholin-4-yl]sulfonylamino]-N-(5-methyl-2-pyridinyl)propanamide
SMILESCc1ccc(NC(=O)CCNS(=O)(=O)N2C[C@@H](C)O[C@@H](C)C2)nc1
InChIInChI=1S/C15H24N4O4S/c1-11-4-5-14(16-8-11)18-15(20)6-7-17-24(21,22)19-9-12(2)23-13(3)10-19/h4-5,8,12-13,17H,6-7,9-10H2,1-3H3,(H,16,18,20)/t12-,13+
InChIKeyKNYBOIZQNRPQAP-BETUJISGSA-N
XLogP0.66
TPSA100.63 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.45
LogP ≤ 50.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 3-[[(2R,6S)-2,6-dimethylmorpholin-4-yl]sulfonylamino]-N-(5-methyl-2-pyridinyl)propanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 3-[[(2R,6S)-2,6-dimethylmorpholin-4-yl]sulfonylamino]-N-(5-methyl-2-pyridinyl)propanamide?
The IUPAC name of 3-[[(2R,6S)-2,6-dimethylmorpholin-4-yl]sulfonylamino]-N-(5-methyl-2-pyridinyl)propanamide (CID 52518103) is 3-[[(2R,6S)-2,6-dimethylmorpholin-4-yl]sulfonylamino]-N-(5-methyl-2-pyridinyl)propanamide.
What is the SMILES notation for 3-[[(2R,6S)-2,6-dimethylmorpholin-4-yl]sulfonylamino]-N-(5-methyl-2-pyridinyl)propanamide?
The canonical SMILES for 3-[[(2R,6S)-2,6-dimethylmorpholin-4-yl]sulfonylamino]-N-(5-methyl-2-pyridinyl)propanamide is Cc1ccc(NC(=O)CCNS(=O)(=O)N2C[C@@H](C)O[C@@H](C)C2)nc1.
What is the InChIKey of 3-[[(2R,6S)-2,6-dimethylmorpholin-4-yl]sulfonylamino]-N-(5-methyl-2-pyridinyl)propanamide?
The InChIKey is KNYBOIZQNRPQAP-BETUJISGSA-N. The full InChI is InChI=1S/C15H24N4O4S/c1-11-4-5-14(16-8-11)18-15(20)6-7-17-24(21,22)19-9-12(2)23-13(3)10-19/h4-5,8,12-13,17H,6-7,9-10H2,1-3H3,(H,16,18,20)/t12-,13+.
What are the key properties of 3-[[(2R,6S)-2,6-dimethylmorpholin-4-yl]sulfonylamino]-N-(5-methyl-2-pyridinyl)propanamide?
3-[[(2R,6S)-2,6-dimethylmorpholin-4-yl]sulfonylamino]-N-(5-methyl-2-pyridinyl)propanamide has a molecular weight of 356.45 g/mol, XLogP of 0.66, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[[(2R,6S)-2,6-dimethylmorpholin-4-yl]sulfonylamino]-N-(5-methyl-2-pyridinyl)propanamide is sourced from PubChem (CID 52518103), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).