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

C14H23N3O3S — CID 75373720

IUPAC2-ethoxy-N-[(4-methylmorpholin-2-yl)methyl]-N-(1,3-thiazol-2-yl)propanamide
SMILESCCOC(C)C(=O)N(CC1CN(C)CCO1)c1nccs1
InChIInChI=1S/C14H23N3O3S/c1-4-19-11(2)13(18)17(14-15-5-8-21-14)10-12-9-16(3)6-7-20-12/h5,8,11-12H,4,6-7,9-10H2,1-3H3
InChIKeyWGONJPLRKVBTLO-UHFFFAOYSA-N
MW313.42 g/mol
LogP1.23
Rot. Bonds6

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

2-ethoxy-N-[(4-methylmorpholin-2-yl)methyl]-N-(1,3-thiazol-2-yl)propanamide (PubChem CID 75373720) has the molecular formula C14H23N3O3S and a molecular weight of 313.42 g/mol. Its IUPAC name is 2-ethoxy-N-[(4-methylmorpholin-2-yl)methyl]-N-(1,3-thiazol-2-yl)propanamide.

Molecular Properties

Compound Name2-ethoxy-N-[(4-methylmorpholin-2-yl)methyl]-N-(1,3-thiazol-2-yl)propanamide
PubChem CID75373720
Molecular FormulaC14H23N3O3S
Molecular Weight313.42 g/mol
Exact Mass313.15
IUPAC Name2-ethoxy-N-[(4-methylmorpholin-2-yl)methyl]-N-(1,3-thiazol-2-yl)propanamide
SMILESCCOC(C)C(=O)N(CC1CN(C)CCO1)c1nccs1
InChIInChI=1S/C14H23N3O3S/c1-4-19-11(2)13(18)17(14-15-5-8-21-14)10-12-9-16(3)6-7-20-12/h5,8,11-12H,4,6-7,9-10H2,1-3H3
InChIKeyWGONJPLRKVBTLO-UHFFFAOYSA-N
XLogP1.23
TPSA54.90 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.42
LogP ≤ 51.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-N-[(4-methylmorpholin-2-yl)methyl]-N-(1,3-thiazol-2-yl)propanamide?
The IUPAC name of 2-ethoxy-N-[(4-methylmorpholin-2-yl)methyl]-N-(1,3-thiazol-2-yl)propanamide (CID 75373720) is 2-ethoxy-N-[(4-methylmorpholin-2-yl)methyl]-N-(1,3-thiazol-2-yl)propanamide.
What is the SMILES notation for 2-ethoxy-N-[(4-methylmorpholin-2-yl)methyl]-N-(1,3-thiazol-2-yl)propanamide?
The canonical SMILES for 2-ethoxy-N-[(4-methylmorpholin-2-yl)methyl]-N-(1,3-thiazol-2-yl)propanamide is CCOC(C)C(=O)N(CC1CN(C)CCO1)c1nccs1.
What is the InChIKey of 2-ethoxy-N-[(4-methylmorpholin-2-yl)methyl]-N-(1,3-thiazol-2-yl)propanamide?
The InChIKey is WGONJPLRKVBTLO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3O3S/c1-4-19-11(2)13(18)17(14-15-5-8-21-14)10-12-9-16(3)6-7-20-12/h5,8,11-12H,4,6-7,9-10H2,1-3H3.
What are the key properties of 2-ethoxy-N-[(4-methylmorpholin-2-yl)methyl]-N-(1,3-thiazol-2-yl)propanamide?
2-ethoxy-N-[(4-methylmorpholin-2-yl)methyl]-N-(1,3-thiazol-2-yl)propanamide has a molecular weight of 313.42 g/mol, XLogP of 1.23, 6 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-N-[(4-methylmorpholin-2-yl)methyl]-N-(1,3-thiazol-2-yl)propanamide is sourced from PubChem (CID 75373720), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).