2-[2-(furan-2-yl)-5-methyl-1,3-oxazol-4-yl]-N-[(1R,2R)-2-imidazol-1-ylcyclopentyl]acetamide

C18H20N4O3 — CID 95765729

IUPAC2-[2-(furan-2-yl)-5-methyl-1,3-oxazol-4-yl]-N-[(1R,2R)-2-imidazol-1-ylcyclopentyl]acetamide
SMILESCc1oc(-c2ccco2)nc1CC(=O)N[C@@H]1CCC[C@H]1n1ccnc1
InChIInChI=1S/C18H20N4O3/c1-12-14(21-18(25-12)16-6-3-9-24-16)10-17(23)20-13-4-2-5-15(13)22-8-7-19-11-22/h3,6-9,11,13,15H,2,4-5,10H2,1H3,(H,20,23)/t13-,15-/m1/s1
InChIKeyWXARLLKKYBVBCC-UKRRQHHQSA-N
MW340.38 g/mol
LogP2.89
Rot. Bonds5

About 2-[2-(furan-2-yl)-5-methyl-1,3-oxazol-4-yl]-N-[(1R,2R)-2-imidazol-1-ylcyclopentyl]acetamide

2-[2-(furan-2-yl)-5-methyl-1,3-oxazol-4-yl]-N-[(1R,2R)-2-imidazol-1-ylcyclopentyl]acetamide (PubChem CID 95765729) has the molecular formula C18H20N4O3 and a molecular weight of 340.38 g/mol. Its IUPAC name is 2-[2-(furan-2-yl)-5-methyl-1,3-oxazol-4-yl]-N-[(1R,2R)-2-imidazol-1-ylcyclopentyl]acetamide.

Molecular Properties

Compound Name2-[2-(furan-2-yl)-5-methyl-1,3-oxazol-4-yl]-N-[(1R,2R)-2-imidazol-1-ylcyclopentyl]acetamide
PubChem CID95765729
Molecular FormulaC18H20N4O3
Molecular Weight340.38 g/mol
Exact Mass340.15
IUPAC Name2-[2-(furan-2-yl)-5-methyl-1,3-oxazol-4-yl]-N-[(1R,2R)-2-imidazol-1-ylcyclopentyl]acetamide
SMILESCc1oc(-c2ccco2)nc1CC(=O)N[C@@H]1CCC[C@H]1n1ccnc1
InChIInChI=1S/C18H20N4O3/c1-12-14(21-18(25-12)16-6-3-9-24-16)10-17(23)20-13-4-2-5-15(13)22-8-7-19-11-22/h3,6-9,11,13,15H,2,4-5,10H2,1H3,(H,20,23)/t13-,15-/m1/s1
InChIKeyWXARLLKKYBVBCC-UKRRQHHQSA-N
XLogP2.89
TPSA86.09 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.38
LogP ≤ 52.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-[2-(furan-2-yl)-5-methyl-1,3-oxazol-4-yl]-N-[(1R,2R)-2-imidazol-1-ylcyclopentyl]acetamide?
The IUPAC name of 2-[2-(furan-2-yl)-5-methyl-1,3-oxazol-4-yl]-N-[(1R,2R)-2-imidazol-1-ylcyclopentyl]acetamide (CID 95765729) is 2-[2-(furan-2-yl)-5-methyl-1,3-oxazol-4-yl]-N-[(1R,2R)-2-imidazol-1-ylcyclopentyl]acetamide.
What is the SMILES notation for 2-[2-(furan-2-yl)-5-methyl-1,3-oxazol-4-yl]-N-[(1R,2R)-2-imidazol-1-ylcyclopentyl]acetamide?
The canonical SMILES for 2-[2-(furan-2-yl)-5-methyl-1,3-oxazol-4-yl]-N-[(1R,2R)-2-imidazol-1-ylcyclopentyl]acetamide is Cc1oc(-c2ccco2)nc1CC(=O)N[C@@H]1CCC[C@H]1n1ccnc1.
What is the InChIKey of 2-[2-(furan-2-yl)-5-methyl-1,3-oxazol-4-yl]-N-[(1R,2R)-2-imidazol-1-ylcyclopentyl]acetamide?
The InChIKey is WXARLLKKYBVBCC-UKRRQHHQSA-N. The full InChI is InChI=1S/C18H20N4O3/c1-12-14(21-18(25-12)16-6-3-9-24-16)10-17(23)20-13-4-2-5-15(13)22-8-7-19-11-22/h3,6-9,11,13,15H,2,4-5,10H2,1H3,(H,20,23)/t13-,15-/m1/s1.
What are the key properties of 2-[2-(furan-2-yl)-5-methyl-1,3-oxazol-4-yl]-N-[(1R,2R)-2-imidazol-1-ylcyclopentyl]acetamide?
2-[2-(furan-2-yl)-5-methyl-1,3-oxazol-4-yl]-N-[(1R,2R)-2-imidazol-1-ylcyclopentyl]acetamide has a molecular weight of 340.38 g/mol, XLogP of 2.89, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(furan-2-yl)-5-methyl-1,3-oxazol-4-yl]-N-[(1R,2R)-2-imidazol-1-ylcyclopentyl]acetamide is sourced from PubChem (CID 95765729), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).