N-(2-methoxyethyl)-3-(2-phenyl-1,3-thiazol-4-yl)propanamide

C15H18N2O2S — CID 110332864

IUPACN-(2-methoxyethyl)-3-(2-phenyl-1,3-thiazol-4-yl)propanamide
SMILESCOCCNC(=O)CCc1csc(-c2ccccc2)n1
InChIInChI=1S/C15H18N2O2S/c1-19-10-9-16-14(18)8-7-13-11-20-15(17-13)12-5-3-2-4-6-12/h2-6,11H,7-10H2,1H3,(H,16,18)
InChIKeyJWVIHJUOSASSSZ-UHFFFAOYSA-N
MW290.39 g/mol
LogP2.51
Rot. Bonds7

About N-(2-methoxyethyl)-3-(2-phenyl-1,3-thiazol-4-yl)propanamide

N-(2-methoxyethyl)-3-(2-phenyl-1,3-thiazol-4-yl)propanamide (PubChem CID 110332864) has the molecular formula C15H18N2O2S and a molecular weight of 290.39 g/mol. Its IUPAC name is N-(2-methoxyethyl)-3-(2-phenyl-1,3-thiazol-4-yl)propanamide.

Molecular Properties

Compound NameN-(2-methoxyethyl)-3-(2-phenyl-1,3-thiazol-4-yl)propanamide
PubChem CID110332864
Molecular FormulaC15H18N2O2S
Molecular Weight290.39 g/mol
Exact Mass290.11
IUPAC NameN-(2-methoxyethyl)-3-(2-phenyl-1,3-thiazol-4-yl)propanamide
SMILESCOCCNC(=O)CCc1csc(-c2ccccc2)n1
InChIInChI=1S/C15H18N2O2S/c1-19-10-9-16-14(18)8-7-13-11-20-15(17-13)12-5-3-2-4-6-12/h2-6,11H,7-10H2,1H3,(H,16,18)
InChIKeyJWVIHJUOSASSSZ-UHFFFAOYSA-N
XLogP2.51
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.39
LogP ≤ 52.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-[4-[3-(2-methoxyethylamino)-3-oxopropyl]-1,3-thiazol-2-yl]benzamide
CID 42208483
N-(2-methoxyethyl)-3-(2-methyl-1,3-thiazol-4-yl)propanamide
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N-(2-methoxyethyl)-2-[4-[2-(2-phenyl-1,3-thiazol-4-yl)acetyl]piperazin-1-yl]acetamide
CID 78817443
N-[2-(4-methoxyphenoxy)ethyl]-3-(2-pyridin-4-yl-1,3-thiazol-4-yl)propanamide
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2-methoxy-N-[2-(2-phenyl-1,3-thiazol-4-yl)ethyl]ethanesulfonamide
CID 110305114
N-[2-[2-(4-methoxyphenyl)-1,3-thiazol-4-yl]ethyl]-2-phenylacetamide
CID 35344893
N-(3-phenylpropyl)-3-(2-pyridin-4-yl-1,3-thiazol-4-yl)propanamide
CID 110330030
3-phenyl-N-[2-(2-pyridin-4-yl-1,3-thiazol-4-yl)ethyl]propanamide
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4-amino-N-[2-(2-phenyl-1,3-thiazol-4-yl)ethyl]butanamide
CID 119266976
3-(furan-2-yl)-N-[2-(2-phenyl-1,3-thiazol-4-yl)ethyl]propanamide
CID 71973739
N-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]-2-(2-phenyl-1,3-thiazol-4-yl)acetamide
CID 38162050
N-[2-[2-(4-fluorophenyl)-1,3-thiazol-4-yl]ethyl]-3-phenylpropanamide
CID 7522122

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyethyl)-3-(2-phenyl-1,3-thiazol-4-yl)propanamide?
The IUPAC name of N-(2-methoxyethyl)-3-(2-phenyl-1,3-thiazol-4-yl)propanamide (CID 110332864) is N-(2-methoxyethyl)-3-(2-phenyl-1,3-thiazol-4-yl)propanamide.
What is the SMILES notation for N-(2-methoxyethyl)-3-(2-phenyl-1,3-thiazol-4-yl)propanamide?
The canonical SMILES for N-(2-methoxyethyl)-3-(2-phenyl-1,3-thiazol-4-yl)propanamide is COCCNC(=O)CCc1csc(-c2ccccc2)n1.
What is the InChIKey of N-(2-methoxyethyl)-3-(2-phenyl-1,3-thiazol-4-yl)propanamide?
The InChIKey is JWVIHJUOSASSSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O2S/c1-19-10-9-16-14(18)8-7-13-11-20-15(17-13)12-5-3-2-4-6-12/h2-6,11H,7-10H2,1H3,(H,16,18).
What are the key properties of N-(2-methoxyethyl)-3-(2-phenyl-1,3-thiazol-4-yl)propanamide?
N-(2-methoxyethyl)-3-(2-phenyl-1,3-thiazol-4-yl)propanamide has a molecular weight of 290.39 g/mol, XLogP of 2.51, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyethyl)-3-(2-phenyl-1,3-thiazol-4-yl)propanamide is sourced from PubChem (CID 110332864), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).