N-(furan-2-ylmethyl)-2-(2-methyl-4-thiophen-2-yl-1,3-thiazol-5-yl)acetamide

C15H14N2O2S2 — CID 20995781

IUPACN-(furan-2-ylmethyl)-2-(2-methyl-4-thiophen-2-yl-1,3-thiazol-5-yl)acetamide
SMILESCc1nc(-c2cccs2)c(CC(=O)NCc2ccco2)s1
InChIInChI=1S/C15H14N2O2S2/c1-10-17-15(12-5-3-7-20-12)13(21-10)8-14(18)16-9-11-4-2-6-19-11/h2-7H,8-9H2,1H3,(H,16,18)
InChIKeyCSHMEKSQNWMPLP-UHFFFAOYSA-N
MW318.42 g/mol
LogP3.63
Rot. Bonds5

About N-(furan-2-ylmethyl)-2-(2-methyl-4-thiophen-2-yl-1,3-thiazol-5-yl)acetamide

N-(furan-2-ylmethyl)-2-(2-methyl-4-thiophen-2-yl-1,3-thiazol-5-yl)acetamide (PubChem CID 20995781) has the molecular formula C15H14N2O2S2 and a molecular weight of 318.42 g/mol. Its IUPAC name is N-(furan-2-ylmethyl)-2-(2-methyl-4-thiophen-2-yl-1,3-thiazol-5-yl)acetamide.

Molecular Properties

Compound NameN-(furan-2-ylmethyl)-2-(2-methyl-4-thiophen-2-yl-1,3-thiazol-5-yl)acetamide
PubChem CID20995781
Molecular FormulaC15H14N2O2S2
Molecular Weight318.42 g/mol
Exact Mass318.05
IUPAC NameN-(furan-2-ylmethyl)-2-(2-methyl-4-thiophen-2-yl-1,3-thiazol-5-yl)acetamide
SMILESCc1nc(-c2cccs2)c(CC(=O)NCc2ccco2)s1
InChIInChI=1S/C15H14N2O2S2/c1-10-17-15(12-5-3-7-20-12)13(21-10)8-14(18)16-9-11-4-2-6-19-11/h2-7H,8-9H2,1H3,(H,16,18)
InChIKeyCSHMEKSQNWMPLP-UHFFFAOYSA-N
XLogP3.63
TPSA55.13 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.42
LogP ≤ 53.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(furan-2-ylmethyl)-2-(2-methyl-4-thiophen-2-yl-1,3-thiazol-5-yl)acetamide?
The IUPAC name of N-(furan-2-ylmethyl)-2-(2-methyl-4-thiophen-2-yl-1,3-thiazol-5-yl)acetamide (CID 20995781) is N-(furan-2-ylmethyl)-2-(2-methyl-4-thiophen-2-yl-1,3-thiazol-5-yl)acetamide.
What is the SMILES notation for N-(furan-2-ylmethyl)-2-(2-methyl-4-thiophen-2-yl-1,3-thiazol-5-yl)acetamide?
The canonical SMILES for N-(furan-2-ylmethyl)-2-(2-methyl-4-thiophen-2-yl-1,3-thiazol-5-yl)acetamide is Cc1nc(-c2cccs2)c(CC(=O)NCc2ccco2)s1.
What is the InChIKey of N-(furan-2-ylmethyl)-2-(2-methyl-4-thiophen-2-yl-1,3-thiazol-5-yl)acetamide?
The InChIKey is CSHMEKSQNWMPLP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N2O2S2/c1-10-17-15(12-5-3-7-20-12)13(21-10)8-14(18)16-9-11-4-2-6-19-11/h2-7H,8-9H2,1H3,(H,16,18).
What are the key properties of N-(furan-2-ylmethyl)-2-(2-methyl-4-thiophen-2-yl-1,3-thiazol-5-yl)acetamide?
N-(furan-2-ylmethyl)-2-(2-methyl-4-thiophen-2-yl-1,3-thiazol-5-yl)acetamide has a molecular weight of 318.42 g/mol, XLogP of 3.63, 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-(2-methyl-4-thiophen-2-yl-1,3-thiazol-5-yl)acetamide is sourced from PubChem (CID 20995781), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).