5-[(2-chlorophenoxy)methyl]-N-[(2-cyclopropyl-1,3-thiazol-4-yl)methyl]furan-2-carboxamide

C19H17ClN2O3S — CID 95749531

IUPAC5-[(2-chlorophenoxy)methyl]-N-[(2-cyclopropyl-1,3-thiazol-4-yl)methyl]furan-2-carboxamide
SMILESO=C(NCc1csc(C2CC2)n1)c1ccc(COc2ccccc2Cl)o1
InChIInChI=1S/C19H17ClN2O3S/c20-15-3-1-2-4-16(15)24-10-14-7-8-17(25-14)18(23)21-9-13-11-26-19(22-13)12-5-6-12/h1-4,7-8,11-12H,5-6,9-10H2,(H,21,23)
InChIKeySTSYZEPUXUZRKS-UHFFFAOYSA-N
MW388.88 g/mol
LogP4.78
Rot. Bonds7

About 5-[(2-chlorophenoxy)methyl]-N-[(2-cyclopropyl-1,3-thiazol-4-yl)methyl]furan-2-carboxamide

5-[(2-chlorophenoxy)methyl]-N-[(2-cyclopropyl-1,3-thiazol-4-yl)methyl]furan-2-carboxamide (PubChem CID 95749531) has the molecular formula C19H17ClN2O3S and a molecular weight of 388.88 g/mol. Its IUPAC name is 5-[(2-chlorophenoxy)methyl]-N-[(2-cyclopropyl-1,3-thiazol-4-yl)methyl]furan-2-carboxamide.

Molecular Properties

Compound Name5-[(2-chlorophenoxy)methyl]-N-[(2-cyclopropyl-1,3-thiazol-4-yl)methyl]furan-2-carboxamide
PubChem CID95749531
Molecular FormulaC19H17ClN2O3S
Molecular Weight388.88 g/mol
Exact Mass388.06
IUPAC Name5-[(2-chlorophenoxy)methyl]-N-[(2-cyclopropyl-1,3-thiazol-4-yl)methyl]furan-2-carboxamide
SMILESO=C(NCc1csc(C2CC2)n1)c1ccc(COc2ccccc2Cl)o1
InChIInChI=1S/C19H17ClN2O3S/c20-15-3-1-2-4-16(15)24-10-14-7-8-17(25-14)18(23)21-9-13-11-26-19(22-13)12-5-6-12/h1-4,7-8,11-12H,5-6,9-10H2,(H,21,23)
InChIKeySTSYZEPUXUZRKS-UHFFFAOYSA-N
XLogP4.78
TPSA64.36 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500388.88
LogP ≤ 54.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 5-[(2-chlorophenoxy)methyl]-N-[(2-cyclopropyl-1,3-thiazol-4-yl)methyl]furan-2-carboxamide with MolForge

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Related Compounds

5-[(2-chlorophenoxy)methyl]-N-[(3,4-dichlorophenyl)methyl]furan-2-carboxamide
CID 4139417
5-[(2-chlorophenoxy)methyl]-N-(pyridin-1-ium-3-ylmethyl)furan-2-carboxamide
CID 3660032
5-[(2-chlorophenoxy)methyl]-N-propan-2-ylfuran-2-carboxamide
CID 6458696
N-(cyclopropylmethyl)-5-[(2,3-dichlorophenoxy)methyl]furan-2-carboxamide
CID 95756198
5-[(2-chlorophenoxy)methyl]-N-(3,3-dimethyl-2-oxobutyl)furan-2-carboxamide
CID 95753482
5-[(4-bromo-3,5-dimethylpyrazol-1-yl)methyl]-N-[(2-cyclopropyl-1,3-thiazol-4-yl)methyl]furan-2-carboxamide
CID 95749537
5-[(2-chlorophenoxy)methyl]furan-2-carbonyl chloride
CID 19619567
N-[(4-bromo-1-ethylpyrazol-3-yl)methyl]-5-[(2-chlorophenoxy)methyl]furan-2-carboxamide
CID 19333135
1-(1-adamantyl)-3-[[5-[(2-chlorophenoxy)methyl]furan-2-carbonyl]amino]urea
CID 4179445
2,4-dichloro-N-[(2-cyclopropyl-1,3-thiazol-4-yl)methyl]benzamide
CID 95324628
5-[(2-methoxyphenoxy)methyl]-N-[(6-methyl-2-pyridinyl)methyl]furan-2-carboxamide
CID 87041704
2-(3-chlorophenyl)-N-[(2-cyclopropyl-1,3-thiazol-4-yl)methyl]acetamide
CID 110727994

Frequently Asked Questions

What is the IUPAC name of 5-[(2-chlorophenoxy)methyl]-N-[(2-cyclopropyl-1,3-thiazol-4-yl)methyl]furan-2-carboxamide?
The IUPAC name of 5-[(2-chlorophenoxy)methyl]-N-[(2-cyclopropyl-1,3-thiazol-4-yl)methyl]furan-2-carboxamide (CID 95749531) is 5-[(2-chlorophenoxy)methyl]-N-[(2-cyclopropyl-1,3-thiazol-4-yl)methyl]furan-2-carboxamide.
What is the SMILES notation for 5-[(2-chlorophenoxy)methyl]-N-[(2-cyclopropyl-1,3-thiazol-4-yl)methyl]furan-2-carboxamide?
The canonical SMILES for 5-[(2-chlorophenoxy)methyl]-N-[(2-cyclopropyl-1,3-thiazol-4-yl)methyl]furan-2-carboxamide is O=C(NCc1csc(C2CC2)n1)c1ccc(COc2ccccc2Cl)o1.
What is the InChIKey of 5-[(2-chlorophenoxy)methyl]-N-[(2-cyclopropyl-1,3-thiazol-4-yl)methyl]furan-2-carboxamide?
The InChIKey is STSYZEPUXUZRKS-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17ClN2O3S/c20-15-3-1-2-4-16(15)24-10-14-7-8-17(25-14)18(23)21-9-13-11-26-19(22-13)12-5-6-12/h1-4,7-8,11-12H,5-6,9-10H2,(H,21,23).
What are the key properties of 5-[(2-chlorophenoxy)methyl]-N-[(2-cyclopropyl-1,3-thiazol-4-yl)methyl]furan-2-carboxamide?
5-[(2-chlorophenoxy)methyl]-N-[(2-cyclopropyl-1,3-thiazol-4-yl)methyl]furan-2-carboxamide has a molecular weight of 388.88 g/mol, XLogP of 4.78, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(2-chlorophenoxy)methyl]-N-[(2-cyclopropyl-1,3-thiazol-4-yl)methyl]furan-2-carboxamide is sourced from PubChem (CID 95749531), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).