N-(furan-2-ylmethyl)-2-[4-(3-methyl-1-benzofuran-2-yl)-1,3-thiazol-2-yl]acetamide

C19H16N2O3S — CID 33401026

IUPACN-(furan-2-ylmethyl)-2-[4-(3-methyl-1-benzofuran-2-yl)-1,3-thiazol-2-yl]acetamide
SMILESCc1c(-c2csc(CC(=O)NCc3ccco3)n2)oc2ccccc12
InChIInChI=1S/C19H16N2O3S/c1-12-14-6-2-3-7-16(14)24-19(12)15-11-25-18(21-15)9-17(22)20-10-13-5-4-8-23-13/h2-8,11H,9-10H2,1H3,(H,20,22)
InChIKeyIKFKIZAOZPHJTP-UHFFFAOYSA-N
MW352.42 g/mol
LogP4.32
Rot. Bonds5

About N-(furan-2-ylmethyl)-2-[4-(3-methyl-1-benzofuran-2-yl)-1,3-thiazol-2-yl]acetamide

N-(furan-2-ylmethyl)-2-[4-(3-methyl-1-benzofuran-2-yl)-1,3-thiazol-2-yl]acetamide (PubChem CID 33401026) has the molecular formula C19H16N2O3S and a molecular weight of 352.42 g/mol. Its IUPAC name is N-(furan-2-ylmethyl)-2-[4-(3-methyl-1-benzofuran-2-yl)-1,3-thiazol-2-yl]acetamide.

Molecular Properties

Compound NameN-(furan-2-ylmethyl)-2-[4-(3-methyl-1-benzofuran-2-yl)-1,3-thiazol-2-yl]acetamide
PubChem CID33401026
Molecular FormulaC19H16N2O3S
Molecular Weight352.42 g/mol
Exact Mass352.09
IUPAC NameN-(furan-2-ylmethyl)-2-[4-(3-methyl-1-benzofuran-2-yl)-1,3-thiazol-2-yl]acetamide
SMILESCc1c(-c2csc(CC(=O)NCc3ccco3)n2)oc2ccccc12
InChIInChI=1S/C19H16N2O3S/c1-12-14-6-2-3-7-16(14)24-19(12)15-11-25-18(21-15)9-17(22)20-10-13-5-4-8-23-13/h2-8,11H,9-10H2,1H3,(H,20,22)
InChIKeyIKFKIZAOZPHJTP-UHFFFAOYSA-N
XLogP4.32
TPSA68.27 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.42
LogP ≤ 54.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(furan-2-ylmethyl)-2-[4-(4-methyl-3-nitrophenyl)-1,3-thiazol-2-yl]acetamide
CID 33400595
2-[4-(3-fluoro-4-methoxyphenyl)-1,3-thiazol-2-yl]-N-(furan-2-ylmethyl)acetamide
CID 33405195
4-(3-methyl-1-benzofuran-2-yl)-1,3-thiazol-2-amine
CID 8878295
N-(furan-2-ylmethyl)-2-naphthalen-1-ylacetamide
CID 823822
2-(furan-2-yl)-N-[(4-propan-2-yl-1,3-thiazol-2-yl)methyl]acetamide
CID 110484643
2-[4-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-1,3-thiazol-2-yl]-N-benzylacetamide
CID 9232946
N-(furan-2-ylmethyl)-2-[4-[(2R)-2-methyl-1-methylsulfonyl-2,3-dihydroindol-5-yl]-1,3-thiazol-2-yl]acetamide
CID 33405157
N-benzyl-2-[4-(5-methylthiophen-2-yl)-1,3-thiazol-2-yl]acetamide
CID 17469813
N-(furan-2-ylmethyl)-2-(2-methyl-1H-indol-3-yl)acetamide
CID 31848406
N-[(3-methyl-1-benzofuran-2-yl)methyl]-2-(2-methyl-1,3-thiazol-4-yl)acetamide
CID 70734151
N-[2-(furan-2-ylmethylamino)-2-oxoethyl]-2-(2-pyridin-2-yl-1,3-thiazol-4-yl)acetamide
CID 51257173
2-(furan-2-yl)-N-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]acetamide
CID 110484612

Frequently Asked Questions

What is the IUPAC name of N-(furan-2-ylmethyl)-2-[4-(3-methyl-1-benzofuran-2-yl)-1,3-thiazol-2-yl]acetamide?
The IUPAC name of N-(furan-2-ylmethyl)-2-[4-(3-methyl-1-benzofuran-2-yl)-1,3-thiazol-2-yl]acetamide (CID 33401026) is N-(furan-2-ylmethyl)-2-[4-(3-methyl-1-benzofuran-2-yl)-1,3-thiazol-2-yl]acetamide.
What is the SMILES notation for N-(furan-2-ylmethyl)-2-[4-(3-methyl-1-benzofuran-2-yl)-1,3-thiazol-2-yl]acetamide?
The canonical SMILES for N-(furan-2-ylmethyl)-2-[4-(3-methyl-1-benzofuran-2-yl)-1,3-thiazol-2-yl]acetamide is Cc1c(-c2csc(CC(=O)NCc3ccco3)n2)oc2ccccc12.
What is the InChIKey of N-(furan-2-ylmethyl)-2-[4-(3-methyl-1-benzofuran-2-yl)-1,3-thiazol-2-yl]acetamide?
The InChIKey is IKFKIZAOZPHJTP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16N2O3S/c1-12-14-6-2-3-7-16(14)24-19(12)15-11-25-18(21-15)9-17(22)20-10-13-5-4-8-23-13/h2-8,11H,9-10H2,1H3,(H,20,22).
What are the key properties of N-(furan-2-ylmethyl)-2-[4-(3-methyl-1-benzofuran-2-yl)-1,3-thiazol-2-yl]acetamide?
N-(furan-2-ylmethyl)-2-[4-(3-methyl-1-benzofuran-2-yl)-1,3-thiazol-2-yl]acetamide has a molecular weight of 352.42 g/mol, XLogP of 4.32, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(furan-2-ylmethyl)-2-[4-(3-methyl-1-benzofuran-2-yl)-1,3-thiazol-2-yl]acetamide is sourced from PubChem (CID 33401026), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).