3-(furan-2-yl)-N-[2-(2-phenyl-1,3-thiazol-4-yl)ethyl]propanamide

C18H18N2O2S — CID 71973739

IUPAC3-(furan-2-yl)-N-[2-(2-phenyl-1,3-thiazol-4-yl)ethyl]propanamide
SMILESO=C(CCc1ccco1)NCCc1csc(-c2ccccc2)n1
InChIInChI=1S/C18H18N2O2S/c21-17(9-8-16-7-4-12-22-16)19-11-10-15-13-23-18(20-15)14-5-2-1-3-6-14/h1-7,12-13H,8-11H2,(H,19,21)
InChIKeyWPBNXMDUKSBYBC-UHFFFAOYSA-N
MW326.42 g/mol
LogP3.69
Rot. Bonds7

About 3-(furan-2-yl)-N-[2-(2-phenyl-1,3-thiazol-4-yl)ethyl]propanamide

3-(furan-2-yl)-N-[2-(2-phenyl-1,3-thiazol-4-yl)ethyl]propanamide (PubChem CID 71973739) has the molecular formula C18H18N2O2S and a molecular weight of 326.42 g/mol. Its IUPAC name is 3-(furan-2-yl)-N-[2-(2-phenyl-1,3-thiazol-4-yl)ethyl]propanamide.

Molecular Properties

Compound Name3-(furan-2-yl)-N-[2-(2-phenyl-1,3-thiazol-4-yl)ethyl]propanamide
PubChem CID71973739
Molecular FormulaC18H18N2O2S
Molecular Weight326.42 g/mol
Exact Mass326.11
IUPAC Name3-(furan-2-yl)-N-[2-(2-phenyl-1,3-thiazol-4-yl)ethyl]propanamide
SMILESO=C(CCc1ccco1)NCCc1csc(-c2ccccc2)n1
InChIInChI=1S/C18H18N2O2S/c21-17(9-8-16-7-4-12-22-16)19-11-10-15-13-23-18(20-15)14-5-2-1-3-6-14/h1-7,12-13H,8-11H2,(H,19,21)
InChIKeyWPBNXMDUKSBYBC-UHFFFAOYSA-N
XLogP3.69
TPSA55.13 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.42
LogP ≤ 53.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-phenyl-N-[2-(2-pyridin-4-yl-1,3-thiazol-4-yl)ethyl]propanamide
CID 112500664
4-amino-N-[2-(2-phenyl-1,3-thiazol-4-yl)ethyl]butanamide
CID 119266976
N-[2-[2-(4-fluorophenyl)-1,3-thiazol-4-yl]ethyl]-3-phenylpropanamide
CID 7522122
7-amino-N-[2-(2-phenyl-1,3-thiazol-4-yl)ethyl]heptanamide
CID 119681392
N-(2-methoxyethyl)-3-(2-phenyl-1,3-thiazol-4-yl)propanamide
CID 110332864
trans-(1R,2R)-2-(furan-2-yl)-N-[2-(2-phenyl-1,3-thiazol-4-yl)ethyl]cyclopropane-1-carboxamide
CID 97030333
N-(furan-2-ylmethyl)-3-[2-(3-methylphenyl)-1,3-thiazol-4-yl]propanamide
CID 110333440
2-(4-chlorophenyl)-N-[2-(2-phenyl-1,3-thiazol-4-yl)ethyl]acetamide
CID 35343942
3-(4,6-dimethyl-2-methylsulfanylpyrimidin-5-yl)-N-[2-(2-phenyl-1,3-thiazol-4-yl)ethyl]propanamide
CID 71922792
N-[2-(2-phenyl-1,3-thiazol-4-yl)ethyl]-3-(3-thiophen-3-yl-1,2,4-oxadiazol-5-yl)propanamide
CID 71922796
N-[2-[5-(4-chlorophenyl)-1,2-oxazol-3-yl]ethyl]-3-(furan-2-yl)propanamide
CID 110312504
N-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]-2-(2-phenyl-1,3-thiazol-4-yl)acetamide
CID 38162050

Frequently Asked Questions

What is the IUPAC name of 3-(furan-2-yl)-N-[2-(2-phenyl-1,3-thiazol-4-yl)ethyl]propanamide?
The IUPAC name of 3-(furan-2-yl)-N-[2-(2-phenyl-1,3-thiazol-4-yl)ethyl]propanamide (CID 71973739) is 3-(furan-2-yl)-N-[2-(2-phenyl-1,3-thiazol-4-yl)ethyl]propanamide.
What is the SMILES notation for 3-(furan-2-yl)-N-[2-(2-phenyl-1,3-thiazol-4-yl)ethyl]propanamide?
The canonical SMILES for 3-(furan-2-yl)-N-[2-(2-phenyl-1,3-thiazol-4-yl)ethyl]propanamide is O=C(CCc1ccco1)NCCc1csc(-c2ccccc2)n1.
What is the InChIKey of 3-(furan-2-yl)-N-[2-(2-phenyl-1,3-thiazol-4-yl)ethyl]propanamide?
The InChIKey is WPBNXMDUKSBYBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N2O2S/c21-17(9-8-16-7-4-12-22-16)19-11-10-15-13-23-18(20-15)14-5-2-1-3-6-14/h1-7,12-13H,8-11H2,(H,19,21).
What are the key properties of 3-(furan-2-yl)-N-[2-(2-phenyl-1,3-thiazol-4-yl)ethyl]propanamide?
3-(furan-2-yl)-N-[2-(2-phenyl-1,3-thiazol-4-yl)ethyl]propanamide has a molecular weight of 326.42 g/mol, XLogP of 3.69, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(furan-2-yl)-N-[2-(2-phenyl-1,3-thiazol-4-yl)ethyl]propanamide is sourced from PubChem (CID 71973739), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).