2-[(4-methylphenoxy)methyl]-N-[(4-methyl-1,3-thiazol-2-yl)methyl]furan-3-carboxamide

C18H18N2O3S — CID 131901713

IUPAC2-[(4-methylphenoxy)methyl]-N-[(4-methyl-1,3-thiazol-2-yl)methyl]furan-3-carboxamide
SMILESCc1ccc(OCc2occc2C(=O)NCc2nc(C)cs2)cc1
InChIInChI=1S/C18H18N2O3S/c1-12-3-5-14(6-4-12)23-10-16-15(7-8-22-16)18(21)19-9-17-20-13(2)11-24-17/h3-8,11H,9-10H2,1-2H3,(H,19,21)
InChIKeyALQUHYGLNPMQDN-UHFFFAOYSA-N
MW342.42 g/mol
LogP3.86
Rot. Bonds6

About 2-[(4-methylphenoxy)methyl]-N-[(4-methyl-1,3-thiazol-2-yl)methyl]furan-3-carboxamide

2-[(4-methylphenoxy)methyl]-N-[(4-methyl-1,3-thiazol-2-yl)methyl]furan-3-carboxamide (PubChem CID 131901713) has the molecular formula C18H18N2O3S and a molecular weight of 342.42 g/mol. Its IUPAC name is 2-[(4-methylphenoxy)methyl]-N-[(4-methyl-1,3-thiazol-2-yl)methyl]furan-3-carboxamide.

Molecular Properties

Compound Name2-[(4-methylphenoxy)methyl]-N-[(4-methyl-1,3-thiazol-2-yl)methyl]furan-3-carboxamide
PubChem CID131901713
Molecular FormulaC18H18N2O3S
Molecular Weight342.42 g/mol
Exact Mass342.10
IUPAC Name2-[(4-methylphenoxy)methyl]-N-[(4-methyl-1,3-thiazol-2-yl)methyl]furan-3-carboxamide
SMILESCc1ccc(OCc2occc2C(=O)NCc2nc(C)cs2)cc1
InChIInChI=1S/C18H18N2O3S/c1-12-3-5-14(6-4-12)23-10-16-15(7-8-22-16)18(21)19-9-17-20-13(2)11-24-17/h3-8,11H,9-10H2,1-2H3,(H,19,21)
InChIKeyALQUHYGLNPMQDN-UHFFFAOYSA-N
XLogP3.86
TPSA64.36 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.42
LogP ≤ 53.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(4-methoxyphenyl)-2-[(4-methylphenoxy)methyl]furan-3-carboxamide
CID 6492523
2-[(4-methylphenoxy)methyl]-N-[(4-propyl-1,2,4-triazol-3-yl)methyl]furan-3-carboxamide
CID 135106836
4-methyl-2-[(4-methylphenoxy)methyl]-1,3-thiazole
CID 78998169
2-[(4-chlorophenoxy)methyl]-N-[(4-methyl-1,3-thiazol-2-yl)methyl]-1,3-thiazole-4-carboxamide
CID 37155823
1-[(2S)-1-(4-methylphenoxy)propan-2-yl]-3-[(4-methyl-1,3-thiazol-2-yl)methyl]urea
CID 95192938
2-(4-ethoxyphenyl)-N-[(4-methyl-1,3-thiazol-2-yl)methyl]acetamide
CID 110746438
N-benzyl-4-[(4-methyl-1,3-thiazol-2-yl)methoxy]benzamide
CID 121094285
4-hydroxy-N-[(4-methyl-1,3-thiazol-2-yl)methyl]benzamide
CID 60709490
2-methyl-N-[(4-methyl-1,3-thiazol-2-yl)methyl]-1H-pyrrole-3-carboxamide
CID 131895425
4-[(4-methyl-1,3-thiazol-2-yl)methoxy]-N-propylbenzamide
CID 121094272
N-[(2,6-difluorophenyl)methyl]-4-[(4-methyl-1,3-thiazol-2-yl)methoxy]benzamide
CID 121094385
N-(2,1,3-benzoxadiazol-4-yl)-2-[(4-methylphenoxy)methyl]furan-3-carboxamide
CID 4970557

Frequently Asked Questions

What is the IUPAC name of 2-[(4-methylphenoxy)methyl]-N-[(4-methyl-1,3-thiazol-2-yl)methyl]furan-3-carboxamide?
The IUPAC name of 2-[(4-methylphenoxy)methyl]-N-[(4-methyl-1,3-thiazol-2-yl)methyl]furan-3-carboxamide (CID 131901713) is 2-[(4-methylphenoxy)methyl]-N-[(4-methyl-1,3-thiazol-2-yl)methyl]furan-3-carboxamide.
What is the SMILES notation for 2-[(4-methylphenoxy)methyl]-N-[(4-methyl-1,3-thiazol-2-yl)methyl]furan-3-carboxamide?
The canonical SMILES for 2-[(4-methylphenoxy)methyl]-N-[(4-methyl-1,3-thiazol-2-yl)methyl]furan-3-carboxamide is Cc1ccc(OCc2occc2C(=O)NCc2nc(C)cs2)cc1.
What is the InChIKey of 2-[(4-methylphenoxy)methyl]-N-[(4-methyl-1,3-thiazol-2-yl)methyl]furan-3-carboxamide?
The InChIKey is ALQUHYGLNPMQDN-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N2O3S/c1-12-3-5-14(6-4-12)23-10-16-15(7-8-22-16)18(21)19-9-17-20-13(2)11-24-17/h3-8,11H,9-10H2,1-2H3,(H,19,21).
What are the key properties of 2-[(4-methylphenoxy)methyl]-N-[(4-methyl-1,3-thiazol-2-yl)methyl]furan-3-carboxamide?
2-[(4-methylphenoxy)methyl]-N-[(4-methyl-1,3-thiazol-2-yl)methyl]furan-3-carboxamide has a molecular weight of 342.42 g/mol, XLogP of 3.86, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-methylphenoxy)methyl]-N-[(4-methyl-1,3-thiazol-2-yl)methyl]furan-3-carboxamide is sourced from PubChem (CID 131901713), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).