N-(4-methylphenyl)-5-(2-methyl-1,3-thiazol-4-yl)furan-2-carboxamide

C16H14N2O2S — CID 110383844

IUPACN-(4-methylphenyl)-5-(2-methyl-1,3-thiazol-4-yl)furan-2-carboxamide
SMILESCc1ccc(NC(=O)c2ccc(-c3csc(C)n3)o2)cc1
InChIInChI=1S/C16H14N2O2S/c1-10-3-5-12(6-4-10)18-16(19)15-8-7-14(20-15)13-9-21-11(2)17-13/h3-9H,1-2H3,(H,18,19)
InChIKeyMMIVRITVTMWXSP-UHFFFAOYSA-N
MW298.37 g/mol
LogP4.27
Rot. Bonds3

About N-(4-methylphenyl)-5-(2-methyl-1,3-thiazol-4-yl)furan-2-carboxamide

N-(4-methylphenyl)-5-(2-methyl-1,3-thiazol-4-yl)furan-2-carboxamide (PubChem CID 110383844) has the molecular formula C16H14N2O2S and a molecular weight of 298.37 g/mol. Its IUPAC name is N-(4-methylphenyl)-5-(2-methyl-1,3-thiazol-4-yl)furan-2-carboxamide.

Molecular Properties

Compound NameN-(4-methylphenyl)-5-(2-methyl-1,3-thiazol-4-yl)furan-2-carboxamide
PubChem CID110383844
Molecular FormulaC16H14N2O2S
Molecular Weight298.37 g/mol
Exact Mass298.08
IUPAC NameN-(4-methylphenyl)-5-(2-methyl-1,3-thiazol-4-yl)furan-2-carboxamide
SMILESCc1ccc(NC(=O)c2ccc(-c3csc(C)n3)o2)cc1
InChIInChI=1S/C16H14N2O2S/c1-10-3-5-12(6-4-10)18-16(19)15-8-7-14(20-15)13-9-21-11(2)17-13/h3-9H,1-2H3,(H,18,19)
InChIKeyMMIVRITVTMWXSP-UHFFFAOYSA-N
XLogP4.27
TPSA55.13 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.37
LogP ≤ 54.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(4-fluorophenyl)-5-(2-methyl-1,3-thiazol-4-yl)furan-2-carboxamide
CID 110383858
N-[4-(diethylamino)phenyl]-5-(2-methyl-1,3-thiazol-4-yl)furan-2-carboxamide
CID 110383889
N-(3-chloro-4-fluorophenyl)-5-(2-methyl-1,3-thiazol-4-yl)furan-2-carboxamide
CID 110383862
N-(3-cyanophenyl)-5-(2-methyl-1,3-thiazol-4-yl)furan-2-carboxamide
CID 110383906
N-(2-bromophenyl)-5-(2-methyl-1,3-thiazol-4-yl)furan-2-carboxamide
CID 110383894
N-cyclopentyl-5-(2-methyl-1,3-thiazol-4-yl)furan-2-carboxamide
CID 110383761
N-(3-methoxypropyl)-5-(2-methyl-1,3-thiazol-4-yl)furan-2-carboxamide
CID 110383767
2-[4-[[2-[4-(2-methyl-1,3-thiazol-4-yl)phenyl]acetyl]amino]phenyl]acetamide
CID 31862065
5-(4-acetylphenyl)-N-(4-methylphenyl)furan-2-carboxamide
CID 9291217
methyl N-[4-(2-methyl-1,3-thiazol-4-yl)phenyl]carbamate
CID 108727310
4-acetamido-N-[4-(2-methyl-1,3-thiazol-4-yl)phenyl]benzamide
CID 27167057
N-[(3,4-dimethoxyphenyl)methyl]-5-(2-methyl-1,3-thiazol-4-yl)furan-2-carboxamide
CID 110383812

Frequently Asked Questions

What is the IUPAC name of N-(4-methylphenyl)-5-(2-methyl-1,3-thiazol-4-yl)furan-2-carboxamide?
The IUPAC name of N-(4-methylphenyl)-5-(2-methyl-1,3-thiazol-4-yl)furan-2-carboxamide (CID 110383844) is N-(4-methylphenyl)-5-(2-methyl-1,3-thiazol-4-yl)furan-2-carboxamide.
What is the SMILES notation for N-(4-methylphenyl)-5-(2-methyl-1,3-thiazol-4-yl)furan-2-carboxamide?
The canonical SMILES for N-(4-methylphenyl)-5-(2-methyl-1,3-thiazol-4-yl)furan-2-carboxamide is Cc1ccc(NC(=O)c2ccc(-c3csc(C)n3)o2)cc1.
What is the InChIKey of N-(4-methylphenyl)-5-(2-methyl-1,3-thiazol-4-yl)furan-2-carboxamide?
The InChIKey is MMIVRITVTMWXSP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14N2O2S/c1-10-3-5-12(6-4-10)18-16(19)15-8-7-14(20-15)13-9-21-11(2)17-13/h3-9H,1-2H3,(H,18,19).
What are the key properties of N-(4-methylphenyl)-5-(2-methyl-1,3-thiazol-4-yl)furan-2-carboxamide?
N-(4-methylphenyl)-5-(2-methyl-1,3-thiazol-4-yl)furan-2-carboxamide has a molecular weight of 298.37 g/mol, XLogP of 4.27, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methylphenyl)-5-(2-methyl-1,3-thiazol-4-yl)furan-2-carboxamide is sourced from PubChem (CID 110383844), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).