3-cyclopropyl-N-[(4-methylmorpholin-2-yl)methyl]-N-(1,3-thiazol-2-yl)propanamide

C15H23N3O2S — CID 75373730

IUPAC3-cyclopropyl-N-[(4-methylmorpholin-2-yl)methyl]-N-(1,3-thiazol-2-yl)propanamide
SMILESCN1CCOC(CN(C(=O)CCC2CC2)c2nccs2)C1
InChIInChI=1S/C15H23N3O2S/c1-17-7-8-20-13(10-17)11-18(15-16-6-9-21-15)14(19)5-4-12-2-3-12/h6,9,12-13H,2-5,7-8,10-11H2,1H3
InChIKeyUTWIIQHBXYPTLG-UHFFFAOYSA-N
MW309.44 g/mol
LogP2.00
Rot. Bonds6

About 3-cyclopropyl-N-[(4-methylmorpholin-2-yl)methyl]-N-(1,3-thiazol-2-yl)propanamide

3-cyclopropyl-N-[(4-methylmorpholin-2-yl)methyl]-N-(1,3-thiazol-2-yl)propanamide (PubChem CID 75373730) has the molecular formula C15H23N3O2S and a molecular weight of 309.44 g/mol. Its IUPAC name is 3-cyclopropyl-N-[(4-methylmorpholin-2-yl)methyl]-N-(1,3-thiazol-2-yl)propanamide.

Molecular Properties

Compound Name3-cyclopropyl-N-[(4-methylmorpholin-2-yl)methyl]-N-(1,3-thiazol-2-yl)propanamide
PubChem CID75373730
Molecular FormulaC15H23N3O2S
Molecular Weight309.44 g/mol
Exact Mass309.15
IUPAC Name3-cyclopropyl-N-[(4-methylmorpholin-2-yl)methyl]-N-(1,3-thiazol-2-yl)propanamide
SMILESCN1CCOC(CN(C(=O)CCC2CC2)c2nccs2)C1
InChIInChI=1S/C15H23N3O2S/c1-17-7-8-20-13(10-17)11-18(15-16-6-9-21-15)14(19)5-4-12-2-3-12/h6,9,12-13H,2-5,7-8,10-11H2,1H3
InChIKeyUTWIIQHBXYPTLG-UHFFFAOYSA-N
XLogP2.00
TPSA45.67 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.44
LogP ≤ 52.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 3-cyclopropyl-N-[(4-methylmorpholin-2-yl)methyl]-N-(1,3-thiazol-2-yl)propanamide?
The IUPAC name of 3-cyclopropyl-N-[(4-methylmorpholin-2-yl)methyl]-N-(1,3-thiazol-2-yl)propanamide (CID 75373730) is 3-cyclopropyl-N-[(4-methylmorpholin-2-yl)methyl]-N-(1,3-thiazol-2-yl)propanamide.
What is the SMILES notation for 3-cyclopropyl-N-[(4-methylmorpholin-2-yl)methyl]-N-(1,3-thiazol-2-yl)propanamide?
The canonical SMILES for 3-cyclopropyl-N-[(4-methylmorpholin-2-yl)methyl]-N-(1,3-thiazol-2-yl)propanamide is CN1CCOC(CN(C(=O)CCC2CC2)c2nccs2)C1.
What is the InChIKey of 3-cyclopropyl-N-[(4-methylmorpholin-2-yl)methyl]-N-(1,3-thiazol-2-yl)propanamide?
The InChIKey is UTWIIQHBXYPTLG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O2S/c1-17-7-8-20-13(10-17)11-18(15-16-6-9-21-15)14(19)5-4-12-2-3-12/h6,9,12-13H,2-5,7-8,10-11H2,1H3.
What are the key properties of 3-cyclopropyl-N-[(4-methylmorpholin-2-yl)methyl]-N-(1,3-thiazol-2-yl)propanamide?
3-cyclopropyl-N-[(4-methylmorpholin-2-yl)methyl]-N-(1,3-thiazol-2-yl)propanamide has a molecular weight of 309.44 g/mol, XLogP of 2.00, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopropyl-N-[(4-methylmorpholin-2-yl)methyl]-N-(1,3-thiazol-2-yl)propanamide is sourced from PubChem (CID 75373730), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).