3-ethyl-N-(5-methyl-1,3-thiazol-2-yl)-2-morpholin-4-ylpentanamide

C15H25N3O2S — CID 75373598

IUPAC3-ethyl-N-(5-methyl-1,3-thiazol-2-yl)-2-morpholin-4-ylpentanamide
SMILESCCC(CC)C(C(=O)Nc1ncc(C)s1)N1CCOCC1
InChIInChI=1S/C15H25N3O2S/c1-4-12(5-2)13(18-6-8-20-9-7-18)14(19)17-15-16-10-11(3)21-15/h10,12-13H,4-9H2,1-3H3,(H,16,17,19)
InChIKeyQBKSWEKICVJJCT-UHFFFAOYSA-N
MW311.45 g/mol
LogP2.53
Rot. Bonds6

About 3-ethyl-N-(5-methyl-1,3-thiazol-2-yl)-2-morpholin-4-ylpentanamide

3-ethyl-N-(5-methyl-1,3-thiazol-2-yl)-2-morpholin-4-ylpentanamide (PubChem CID 75373598) has the molecular formula C15H25N3O2S and a molecular weight of 311.45 g/mol. Its IUPAC name is 3-ethyl-N-(5-methyl-1,3-thiazol-2-yl)-2-morpholin-4-ylpentanamide.

Molecular Properties

Compound Name3-ethyl-N-(5-methyl-1,3-thiazol-2-yl)-2-morpholin-4-ylpentanamide
PubChem CID75373598
Molecular FormulaC15H25N3O2S
Molecular Weight311.45 g/mol
Exact Mass311.17
IUPAC Name3-ethyl-N-(5-methyl-1,3-thiazol-2-yl)-2-morpholin-4-ylpentanamide
SMILESCCC(CC)C(C(=O)Nc1ncc(C)s1)N1CCOCC1
InChIInChI=1S/C15H25N3O2S/c1-4-12(5-2)13(18-6-8-20-9-7-18)14(19)17-15-16-10-11(3)21-15/h10,12-13H,4-9H2,1-3H3,(H,16,17,19)
InChIKeyQBKSWEKICVJJCT-UHFFFAOYSA-N
XLogP2.53
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.45
LogP ≤ 52.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 3-ethyl-N-(5-methyl-1,3-thiazol-2-yl)-2-morpholin-4-ylpentanamide?
The IUPAC name of 3-ethyl-N-(5-methyl-1,3-thiazol-2-yl)-2-morpholin-4-ylpentanamide (CID 75373598) is 3-ethyl-N-(5-methyl-1,3-thiazol-2-yl)-2-morpholin-4-ylpentanamide.
What is the SMILES notation for 3-ethyl-N-(5-methyl-1,3-thiazol-2-yl)-2-morpholin-4-ylpentanamide?
The canonical SMILES for 3-ethyl-N-(5-methyl-1,3-thiazol-2-yl)-2-morpholin-4-ylpentanamide is CCC(CC)C(C(=O)Nc1ncc(C)s1)N1CCOCC1.
What is the InChIKey of 3-ethyl-N-(5-methyl-1,3-thiazol-2-yl)-2-morpholin-4-ylpentanamide?
The InChIKey is QBKSWEKICVJJCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3O2S/c1-4-12(5-2)13(18-6-8-20-9-7-18)14(19)17-15-16-10-11(3)21-15/h10,12-13H,4-9H2,1-3H3,(H,16,17,19).
What are the key properties of 3-ethyl-N-(5-methyl-1,3-thiazol-2-yl)-2-morpholin-4-ylpentanamide?
3-ethyl-N-(5-methyl-1,3-thiazol-2-yl)-2-morpholin-4-ylpentanamide has a molecular weight of 311.45 g/mol, XLogP of 2.53, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-N-(5-methyl-1,3-thiazol-2-yl)-2-morpholin-4-ylpentanamide is sourced from PubChem (CID 75373598), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).