4-[(4-methyl-1,3-thiazol-2-yl)methoxy]-N-propylbenzamide

C15H18N2O2S — CID 121094272

IUPAC4-[(4-methyl-1,3-thiazol-2-yl)methoxy]-N-propylbenzamide
SMILESCCCNC(=O)c1ccc(OCc2nc(C)cs2)cc1
InChIInChI=1S/C15H18N2O2S/c1-3-8-16-15(18)12-4-6-13(7-5-12)19-9-14-17-11(2)10-20-14/h4-7,10H,3,8-9H2,1-2H3,(H,16,18)
InChIKeyZGWSWUMBFUKFBP-UHFFFAOYSA-N
MW290.39 g/mol
LogP3.17
Rot. Bonds6

About 4-[(4-methyl-1,3-thiazol-2-yl)methoxy]-N-propylbenzamide

4-[(4-methyl-1,3-thiazol-2-yl)methoxy]-N-propylbenzamide (PubChem CID 121094272) has the molecular formula C15H18N2O2S and a molecular weight of 290.39 g/mol. Its IUPAC name is 4-[(4-methyl-1,3-thiazol-2-yl)methoxy]-N-propylbenzamide.

Molecular Properties

Compound Name4-[(4-methyl-1,3-thiazol-2-yl)methoxy]-N-propylbenzamide
PubChem CID121094272
Molecular FormulaC15H18N2O2S
Molecular Weight290.39 g/mol
Exact Mass290.11
IUPAC Name4-[(4-methyl-1,3-thiazol-2-yl)methoxy]-N-propylbenzamide
SMILESCCCNC(=O)c1ccc(OCc2nc(C)cs2)cc1
InChIInChI=1S/C15H18N2O2S/c1-3-8-16-15(18)12-4-6-13(7-5-12)19-9-14-17-11(2)10-20-14/h4-7,10H,3,8-9H2,1-2H3,(H,16,18)
InChIKeyZGWSWUMBFUKFBP-UHFFFAOYSA-N
XLogP3.17
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.39
LogP ≤ 53.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-benzyl-4-[(4-methyl-1,3-thiazol-2-yl)methoxy]benzamide
CID 121094285
N-[(2,6-difluorophenyl)methyl]-4-[(4-methyl-1,3-thiazol-2-yl)methoxy]benzamide
CID 121094385
N-butan-2-yl-4-[(4-methyl-1,3-thiazol-2-yl)methoxy]benzamide
CID 121094276
N-cyclohexyl-4-[(4-methyl-1,3-thiazol-2-yl)methoxy]benzamide
CID 121094282
N-[2-[(4-fluorobenzoyl)amino]ethyl]-2-[(4-methylphenoxy)methyl]-1,3-thiazole-4-carboxamide
CID 46105822
4-methyl-2-[(4-methylphenoxy)methyl]-1,3-thiazole
CID 78998169
2-[2-[(6-methyl-3-pyridinyl)oxymethyl]-1,3-thiazol-4-yl]-N-propylacetamide
CID 110341832
4-[(4-methyl-1,3-thiazol-2-yl)methoxy]-N-[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]benzamide
CID 121094244
[4-[(4-methyl-1,3-thiazol-2-yl)methoxy]phenyl]-pyrrolidin-1-ylmethanone
CID 121094251
N-(4-bromo-2-methylphenyl)-4-[(4-methyl-1,3-thiazol-2-yl)methoxy]benzamide
CID 121094364
N-(3-fluorophenyl)-4-[(4-methyl-1,3-thiazol-2-yl)methoxy]benzamide
CID 121094316
ethyl 2-[2-[[4-[(4-methyl-1,3-thiazol-2-yl)methoxy]benzoyl]amino]-1,3-thiazol-4-yl]acetate
CID 121094373

Frequently Asked Questions

What is the IUPAC name of 4-[(4-methyl-1,3-thiazol-2-yl)methoxy]-N-propylbenzamide?
The IUPAC name of 4-[(4-methyl-1,3-thiazol-2-yl)methoxy]-N-propylbenzamide (CID 121094272) is 4-[(4-methyl-1,3-thiazol-2-yl)methoxy]-N-propylbenzamide.
What is the SMILES notation for 4-[(4-methyl-1,3-thiazol-2-yl)methoxy]-N-propylbenzamide?
The canonical SMILES for 4-[(4-methyl-1,3-thiazol-2-yl)methoxy]-N-propylbenzamide is CCCNC(=O)c1ccc(OCc2nc(C)cs2)cc1.
What is the InChIKey of 4-[(4-methyl-1,3-thiazol-2-yl)methoxy]-N-propylbenzamide?
The InChIKey is ZGWSWUMBFUKFBP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O2S/c1-3-8-16-15(18)12-4-6-13(7-5-12)19-9-14-17-11(2)10-20-14/h4-7,10H,3,8-9H2,1-2H3,(H,16,18).
What are the key properties of 4-[(4-methyl-1,3-thiazol-2-yl)methoxy]-N-propylbenzamide?
4-[(4-methyl-1,3-thiazol-2-yl)methoxy]-N-propylbenzamide has a molecular weight of 290.39 g/mol, XLogP of 3.17, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(4-methyl-1,3-thiazol-2-yl)methoxy]-N-propylbenzamide is sourced from PubChem (CID 121094272), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).