N-[5-[(2-chlorophenyl)methyl]-1,3-thiazol-2-yl]-5-(ethoxymethyl)furan-2-carboxamide

C18H17ClN2O3S — CID 18830695

IUPACN-[5-[(2-chlorophenyl)methyl]-1,3-thiazol-2-yl]-5-(ethoxymethyl)furan-2-carboxamide
SMILESCCOCc1ccc(C(=O)Nc2ncc(Cc3ccccc3Cl)s2)o1
InChIInChI=1S/C18H17ClN2O3S/c1-2-23-11-13-7-8-16(24-13)17(22)21-18-20-10-14(25-18)9-12-5-3-4-6-15(12)19/h3-8,10H,2,9,11H2,1H3,(H,20,21,22)
InChIKeyIFPDZNKQODONBJ-UHFFFAOYSA-N
MW376.87 g/mol
LogP4.77
Rot. Bonds7

About N-[5-[(2-chlorophenyl)methyl]-1,3-thiazol-2-yl]-5-(ethoxymethyl)furan-2-carboxamide

N-[5-[(2-chlorophenyl)methyl]-1,3-thiazol-2-yl]-5-(ethoxymethyl)furan-2-carboxamide (PubChem CID 18830695) has the molecular formula C18H17ClN2O3S and a molecular weight of 376.87 g/mol. Its IUPAC name is N-[5-[(2-chlorophenyl)methyl]-1,3-thiazol-2-yl]-5-(ethoxymethyl)furan-2-carboxamide.

Molecular Properties

Compound NameN-[5-[(2-chlorophenyl)methyl]-1,3-thiazol-2-yl]-5-(ethoxymethyl)furan-2-carboxamide
PubChem CID18830695
Molecular FormulaC18H17ClN2O3S
Molecular Weight376.87 g/mol
Exact Mass376.06
IUPAC NameN-[5-[(2-chlorophenyl)methyl]-1,3-thiazol-2-yl]-5-(ethoxymethyl)furan-2-carboxamide
SMILESCCOCc1ccc(C(=O)Nc2ncc(Cc3ccccc3Cl)s2)o1
InChIInChI=1S/C18H17ClN2O3S/c1-2-23-11-13-7-8-16(24-13)17(22)21-18-20-10-14(25-18)9-12-5-3-4-6-15(12)19/h3-8,10H,2,9,11H2,1H3,(H,20,21,22)
InChIKeyIFPDZNKQODONBJ-UHFFFAOYSA-N
XLogP4.77
TPSA64.36 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.87
LogP ≤ 54.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[5-[(2-chlorophenyl)methyl]-1,3-thiazol-2-yl]-4-phenoxybenzamide
CID 16651562
2-chloro-N-[5-[(2-chlorophenyl)methyl]-1,3-thiazol-2-yl]propanamide
CID 4969221
N-[5-[(2-chlorophenyl)methyl]-1,3-thiazol-2-yl]-6-methylpyridine-3-carboxamide
CID 46511635
N-[5-[(2-chlorophenyl)methyl]-1,3-thiazol-2-yl]-2-methyl-6-oxo-1H-pyrimidine-4-carboxamide
CID 135963079
N-[5-[(2-chlorophenyl)methyl]-1,3-thiazol-2-yl]-2-cyano-2-methylpropanamide
CID 60779121
3-acetamido-N-[5-[(2-chlorophenyl)methyl]-1,3-thiazol-2-yl]benzamide
CID 36782312
N-[5-[(2-chlorophenyl)methyl]-1,3-thiazol-2-yl]-2,6-dimethoxypyrimidine-4-carboxamide
CID 46970158
3-amino-N-[5-[(2-chlorophenyl)methyl]-1,3-thiazol-2-yl]butanamide
CID 119698331
2-amino-N-[5-[(2-chlorophenyl)methyl]-1,3-thiazol-2-yl]-3-methoxypropanamide
CID 120984436
N-[5-[(2-chlorophenyl)methyl]-1,3-thiazol-2-yl]-2-(diethylamino)butanamide
CID 58033042
N-[5-[(2-chlorophenyl)methyl]-1,3-thiazol-2-yl]-4-(methanesulfonamido)benzamide
CID 46510170
N-[5-[(2-chlorophenyl)methyl]-1,3-thiazol-2-yl]-3-methylsulfanylpropanamide
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Frequently Asked Questions

What is the IUPAC name of N-[5-[(2-chlorophenyl)methyl]-1,3-thiazol-2-yl]-5-(ethoxymethyl)furan-2-carboxamide?
The IUPAC name of N-[5-[(2-chlorophenyl)methyl]-1,3-thiazol-2-yl]-5-(ethoxymethyl)furan-2-carboxamide (CID 18830695) is N-[5-[(2-chlorophenyl)methyl]-1,3-thiazol-2-yl]-5-(ethoxymethyl)furan-2-carboxamide.
What is the SMILES notation for N-[5-[(2-chlorophenyl)methyl]-1,3-thiazol-2-yl]-5-(ethoxymethyl)furan-2-carboxamide?
The canonical SMILES for N-[5-[(2-chlorophenyl)methyl]-1,3-thiazol-2-yl]-5-(ethoxymethyl)furan-2-carboxamide is CCOCc1ccc(C(=O)Nc2ncc(Cc3ccccc3Cl)s2)o1.
What is the InChIKey of N-[5-[(2-chlorophenyl)methyl]-1,3-thiazol-2-yl]-5-(ethoxymethyl)furan-2-carboxamide?
The InChIKey is IFPDZNKQODONBJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17ClN2O3S/c1-2-23-11-13-7-8-16(24-13)17(22)21-18-20-10-14(25-18)9-12-5-3-4-6-15(12)19/h3-8,10H,2,9,11H2,1H3,(H,20,21,22).
What are the key properties of N-[5-[(2-chlorophenyl)methyl]-1,3-thiazol-2-yl]-5-(ethoxymethyl)furan-2-carboxamide?
N-[5-[(2-chlorophenyl)methyl]-1,3-thiazol-2-yl]-5-(ethoxymethyl)furan-2-carboxamide has a molecular weight of 376.87 g/mol, XLogP of 4.77, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-[(2-chlorophenyl)methyl]-1,3-thiazol-2-yl]-5-(ethoxymethyl)furan-2-carboxamide is sourced from PubChem (CID 18830695), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).