2-(2,6-dimethylmorpholin-4-yl)-N,3-dimethyl-N-(1,3-thiazol-2-yl)butanamide

C15H25N3O2S — CID 60586176

IUPAC2-(2,6-dimethylmorpholin-4-yl)-N,3-dimethyl-N-(1,3-thiazol-2-yl)butanamide
SMILESCC1CN(C(C(=O)N(C)c2nccs2)C(C)C)CC(C)O1
InChIInChI=1S/C15H25N3O2S/c1-10(2)13(18-8-11(3)20-12(4)9-18)14(19)17(5)15-16-6-7-21-15/h6-7,10-13H,8-9H2,1-5H3
InChIKeySISQQQDDPSNUGN-UHFFFAOYSA-N
MW311.45 g/mol
LogP2.24
Rot. Bonds4

About 2-(2,6-dimethylmorpholin-4-yl)-N,3-dimethyl-N-(1,3-thiazol-2-yl)butanamide

2-(2,6-dimethylmorpholin-4-yl)-N,3-dimethyl-N-(1,3-thiazol-2-yl)butanamide (PubChem CID 60586176) has the molecular formula C15H25N3O2S and a molecular weight of 311.45 g/mol. Its IUPAC name is 2-(2,6-dimethylmorpholin-4-yl)-N,3-dimethyl-N-(1,3-thiazol-2-yl)butanamide.

Molecular Properties

Compound Name2-(2,6-dimethylmorpholin-4-yl)-N,3-dimethyl-N-(1,3-thiazol-2-yl)butanamide
PubChem CID60586176
Molecular FormulaC15H25N3O2S
Molecular Weight311.45 g/mol
Exact Mass311.17
IUPAC Name2-(2,6-dimethylmorpholin-4-yl)-N,3-dimethyl-N-(1,3-thiazol-2-yl)butanamide
SMILESCC1CN(C(C(=O)N(C)c2nccs2)C(C)C)CC(C)O1
InChIInChI=1S/C15H25N3O2S/c1-10(2)13(18-8-11(3)20-12(4)9-18)14(19)17(5)15-16-6-7-21-15/h6-7,10-13H,8-9H2,1-5H3
InChIKeySISQQQDDPSNUGN-UHFFFAOYSA-N
XLogP2.24
TPSA45.67 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.45
LogP ≤ 52.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(2,6-dimethylmorpholin-4-yl)-N,3-dimethyl-N-(1,3-thiazol-2-yl)butanamide?
The IUPAC name of 2-(2,6-dimethylmorpholin-4-yl)-N,3-dimethyl-N-(1,3-thiazol-2-yl)butanamide (CID 60586176) is 2-(2,6-dimethylmorpholin-4-yl)-N,3-dimethyl-N-(1,3-thiazol-2-yl)butanamide.
What is the SMILES notation for 2-(2,6-dimethylmorpholin-4-yl)-N,3-dimethyl-N-(1,3-thiazol-2-yl)butanamide?
The canonical SMILES for 2-(2,6-dimethylmorpholin-4-yl)-N,3-dimethyl-N-(1,3-thiazol-2-yl)butanamide is CC1CN(C(C(=O)N(C)c2nccs2)C(C)C)CC(C)O1.
What is the InChIKey of 2-(2,6-dimethylmorpholin-4-yl)-N,3-dimethyl-N-(1,3-thiazol-2-yl)butanamide?
The InChIKey is SISQQQDDPSNUGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3O2S/c1-10(2)13(18-8-11(3)20-12(4)9-18)14(19)17(5)15-16-6-7-21-15/h6-7,10-13H,8-9H2,1-5H3.
What are the key properties of 2-(2,6-dimethylmorpholin-4-yl)-N,3-dimethyl-N-(1,3-thiazol-2-yl)butanamide?
2-(2,6-dimethylmorpholin-4-yl)-N,3-dimethyl-N-(1,3-thiazol-2-yl)butanamide has a molecular weight of 311.45 g/mol, XLogP of 2.24, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,6-dimethylmorpholin-4-yl)-N,3-dimethyl-N-(1,3-thiazol-2-yl)butanamide is sourced from PubChem (CID 60586176), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).