N-ethyl-N-(2-methoxyethyl)-3-(4-methyl-1,3-thiazol-5-yl)propanamide

C12H20N2O2S — CID 70741473

IUPACN-ethyl-N-(2-methoxyethyl)-3-(4-methyl-1,3-thiazol-5-yl)propanamide
SMILESCCN(CCOC)C(=O)CCc1scnc1C
InChIInChI=1S/C12H20N2O2S/c1-4-14(7-8-16-3)12(15)6-5-11-10(2)13-9-17-11/h9H,4-8H2,1-3H3
InChIKeyKPIKINLAZZBFBW-UHFFFAOYSA-N
MW256.37 g/mol
LogP1.88
Rot. Bonds7

About N-ethyl-N-(2-methoxyethyl)-3-(4-methyl-1,3-thiazol-5-yl)propanamide

N-ethyl-N-(2-methoxyethyl)-3-(4-methyl-1,3-thiazol-5-yl)propanamide (PubChem CID 70741473) has the molecular formula C12H20N2O2S and a molecular weight of 256.37 g/mol. Its IUPAC name is N-ethyl-N-(2-methoxyethyl)-3-(4-methyl-1,3-thiazol-5-yl)propanamide.

Molecular Properties

Compound NameN-ethyl-N-(2-methoxyethyl)-3-(4-methyl-1,3-thiazol-5-yl)propanamide
PubChem CID70741473
Molecular FormulaC12H20N2O2S
Molecular Weight256.37 g/mol
Exact Mass256.12
IUPAC NameN-ethyl-N-(2-methoxyethyl)-3-(4-methyl-1,3-thiazol-5-yl)propanamide
SMILESCCN(CCOC)C(=O)CCc1scnc1C
InChIInChI=1S/C12H20N2O2S/c1-4-14(7-8-16-3)12(15)6-5-11-10(2)13-9-17-11/h9H,4-8H2,1-3H3
InChIKeyKPIKINLAZZBFBW-UHFFFAOYSA-N
XLogP1.88
TPSA42.43 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.37
LogP ≤ 51.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-(2-methoxyethyl)-3-(4-methyl-1,3-thiazol-5-yl)propanamide?
The IUPAC name of N-ethyl-N-(2-methoxyethyl)-3-(4-methyl-1,3-thiazol-5-yl)propanamide (CID 70741473) is N-ethyl-N-(2-methoxyethyl)-3-(4-methyl-1,3-thiazol-5-yl)propanamide.
What is the SMILES notation for N-ethyl-N-(2-methoxyethyl)-3-(4-methyl-1,3-thiazol-5-yl)propanamide?
The canonical SMILES for N-ethyl-N-(2-methoxyethyl)-3-(4-methyl-1,3-thiazol-5-yl)propanamide is CCN(CCOC)C(=O)CCc1scnc1C.
What is the InChIKey of N-ethyl-N-(2-methoxyethyl)-3-(4-methyl-1,3-thiazol-5-yl)propanamide?
The InChIKey is KPIKINLAZZBFBW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2O2S/c1-4-14(7-8-16-3)12(15)6-5-11-10(2)13-9-17-11/h9H,4-8H2,1-3H3.
What are the key properties of N-ethyl-N-(2-methoxyethyl)-3-(4-methyl-1,3-thiazol-5-yl)propanamide?
N-ethyl-N-(2-methoxyethyl)-3-(4-methyl-1,3-thiazol-5-yl)propanamide has a molecular weight of 256.37 g/mol, XLogP of 1.88, 7 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-(2-methoxyethyl)-3-(4-methyl-1,3-thiazol-5-yl)propanamide is sourced from PubChem (CID 70741473), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).