N-[2-[5-(4-chlorophenyl)-1,2-oxazol-3-yl]ethyl]-3-(furan-2-yl)propanamide

C18H17ClN2O3 — CID 110312504

IUPACN-[2-[5-(4-chlorophenyl)-1,2-oxazol-3-yl]ethyl]-3-(furan-2-yl)propanamide
SMILESO=C(CCc1ccco1)NCCc1cc(-c2ccc(Cl)cc2)on1
InChIInChI=1S/C18H17ClN2O3/c19-14-5-3-13(4-6-14)17-12-15(21-24-17)9-10-20-18(22)8-7-16-2-1-11-23-16/h1-6,11-12H,7-10H2,(H,20,22)
InChIKeyLDUYGUFDXXPJCN-UHFFFAOYSA-N
MW344.80 g/mol
LogP3.88
Rot. Bonds7

About N-[2-[5-(4-chlorophenyl)-1,2-oxazol-3-yl]ethyl]-3-(furan-2-yl)propanamide

N-[2-[5-(4-chlorophenyl)-1,2-oxazol-3-yl]ethyl]-3-(furan-2-yl)propanamide (PubChem CID 110312504) has the molecular formula C18H17ClN2O3 and a molecular weight of 344.80 g/mol. Its IUPAC name is N-[2-[5-(4-chlorophenyl)-1,2-oxazol-3-yl]ethyl]-3-(furan-2-yl)propanamide.

Molecular Properties

Compound NameN-[2-[5-(4-chlorophenyl)-1,2-oxazol-3-yl]ethyl]-3-(furan-2-yl)propanamide
PubChem CID110312504
Molecular FormulaC18H17ClN2O3
Molecular Weight344.80 g/mol
Exact Mass344.09
IUPAC NameN-[2-[5-(4-chlorophenyl)-1,2-oxazol-3-yl]ethyl]-3-(furan-2-yl)propanamide
SMILESO=C(CCc1ccco1)NCCc1cc(-c2ccc(Cl)cc2)on1
InChIInChI=1S/C18H17ClN2O3/c19-14-5-3-13(4-6-14)17-12-15(21-24-17)9-10-20-18(22)8-7-16-2-1-11-23-16/h1-6,11-12H,7-10H2,(H,20,22)
InChIKeyLDUYGUFDXXPJCN-UHFFFAOYSA-N
XLogP3.88
TPSA68.27 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.80
LogP ≤ 53.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-(furan-2-yl)-N-[2-(2-phenyl-1,3-thiazol-4-yl)ethyl]propanamide
CID 71973739
N-[2-(4-chlorophenoxy)ethyl]-3-(furan-2-yl)propanamide
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N-(2-aminoethyl)-3-(furan-2-yl)propanamide
CID 28779702
3-acetamido-N-[2-(5-phenyl-1,2-oxazol-3-yl)ethyl]propanamide
CID 110633970
1-[5-(4-chlorophenyl)-1,2-oxazol-3-yl]-N-(furan-2-ylmethyl)cyclopropane-1-carboxamide
CID 90504356
N-[2-[5-(4-chlorophenyl)-1,2-oxazol-3-yl]ethyl]oxolane-2-carboxamide
CID 110314737
N-[2-[5-(4-chlorophenyl)-1,2-oxazol-3-yl]ethyl]-4-methoxybenzamide
CID 110314743
2-[5-(4-chlorophenyl)-1,2-oxazol-3-yl]-N-(2-methoxyethyl)acetamide
CID 16878595
2-(4-chlorophenyl)-N-[[5-(4-chlorophenyl)-1,2-oxazol-3-yl]methyl]acetamide
CID 16866804
2-[5-(4-chlorophenyl)-1,2-oxazol-3-yl]-N-(3-methylbutyl)acetamide
CID 16878594
N-[2-(5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)ethyl]-3-(furan-2-yl)propanamide
CID 24630311
N-[2-(4-chlorophenyl)ethyl]-2-[[5-(4-fluorophenyl)-1,2-oxazol-3-yl]methoxy]acetamide
CID 20906265

Frequently Asked Questions

What is the IUPAC name of N-[2-[5-(4-chlorophenyl)-1,2-oxazol-3-yl]ethyl]-3-(furan-2-yl)propanamide?
The IUPAC name of N-[2-[5-(4-chlorophenyl)-1,2-oxazol-3-yl]ethyl]-3-(furan-2-yl)propanamide (CID 110312504) is N-[2-[5-(4-chlorophenyl)-1,2-oxazol-3-yl]ethyl]-3-(furan-2-yl)propanamide.
What is the SMILES notation for N-[2-[5-(4-chlorophenyl)-1,2-oxazol-3-yl]ethyl]-3-(furan-2-yl)propanamide?
The canonical SMILES for N-[2-[5-(4-chlorophenyl)-1,2-oxazol-3-yl]ethyl]-3-(furan-2-yl)propanamide is O=C(CCc1ccco1)NCCc1cc(-c2ccc(Cl)cc2)on1.
What is the InChIKey of N-[2-[5-(4-chlorophenyl)-1,2-oxazol-3-yl]ethyl]-3-(furan-2-yl)propanamide?
The InChIKey is LDUYGUFDXXPJCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17ClN2O3/c19-14-5-3-13(4-6-14)17-12-15(21-24-17)9-10-20-18(22)8-7-16-2-1-11-23-16/h1-6,11-12H,7-10H2,(H,20,22).
What are the key properties of N-[2-[5-(4-chlorophenyl)-1,2-oxazol-3-yl]ethyl]-3-(furan-2-yl)propanamide?
N-[2-[5-(4-chlorophenyl)-1,2-oxazol-3-yl]ethyl]-3-(furan-2-yl)propanamide has a molecular weight of 344.80 g/mol, XLogP of 3.88, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[5-(4-chlorophenyl)-1,2-oxazol-3-yl]ethyl]-3-(furan-2-yl)propanamide is sourced from PubChem (CID 110312504), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).