5-ethyl-N-pentyl-1,2-oxazole-3-carboxamide

C11H18N2O2 — CID 160831155

IUPAC5-ethyl-N-pentyl-1,2-oxazole-3-carboxamide
SMILESCCCCCNC(=O)c1cc(CC)on1
InChIInChI=1S/C11H18N2O2/c1-3-5-6-7-12-11(14)10-8-9(4-2)15-13-10/h8H,3-7H2,1-2H3,(H,12,14)
InChIKeyADSMCHVNMLUBED-UHFFFAOYSA-N
MW210.28 g/mol
LogP2.16
Rot. Bonds6

About 5-ethyl-N-pentyl-1,2-oxazole-3-carboxamide

5-ethyl-N-pentyl-1,2-oxazole-3-carboxamide (PubChem CID 160831155) has the molecular formula C11H18N2O2 and a molecular weight of 210.28 g/mol. Its IUPAC name is 5-ethyl-N-pentyl-1,2-oxazole-3-carboxamide.

Molecular Properties

Compound Name5-ethyl-N-pentyl-1,2-oxazole-3-carboxamide
PubChem CID160831155
Molecular FormulaC11H18N2O2
Molecular Weight210.28 g/mol
Exact Mass210.14
IUPAC Name5-ethyl-N-pentyl-1,2-oxazole-3-carboxamide
SMILESCCCCCNC(=O)c1cc(CC)on1
InChIInChI=1S/C11H18N2O2/c1-3-5-6-7-12-11(14)10-8-9(4-2)15-13-10/h8H,3-7H2,1-2H3,(H,12,14)
InChIKeyADSMCHVNMLUBED-UHFFFAOYSA-N
XLogP2.16
TPSA55.13 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.28
LogP ≤ 52.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-(2,2-dimethylheptyl)-5-ethyl-1,2-oxazole-3-carboxamide
CID 160550782
N-(3,3-dimethyloctan-2-yl)-5-ethyl-1,2-oxazole-3-carboxamide
CID 158921708
3-methyl-N-pentyl-1,2-oxazole-5-carboxamide
CID 137320445
N-[3-(dimethylamino)propyl]-5-(hydroxymethyl)-1,2-oxazole-3-carboxamide
CID 118698825
N-(8-azabicyclo[3.2.1]octan-3-yl)-5-ethyl-1,2-oxazole-3-carboxamide
CID 140824507
5-ethyl-N-[2-(4-fluorophenyl)sulfonylethyl]-1,2-oxazole-3-carboxamide
CID 74232862
5-ethyl-N-(3-ethyl-3-methyloctan-2-yl)-1,2-oxazole-3-carboxamide
CID 162165201
3-[(5-ethyl-1,2-oxazole-3-carbonyl)amino]-3-methylbutanoic acid
CID 110836534
5-(1,3-benzodioxol-5-yl)-N-pentyl-1,2-oxazole-3-carboxamide
CID 46087349
5-(3-methoxyphenyl)-N-pentyl-1,2-oxazole-3-carboxamide
CID 110317131
2-N,6-N-didecylpyridine-2,6-dicarboxamide
CID 4564479
5-(4-bromophenyl)-N-butyl-1,2-oxazole-3-carboxamide
CID 22427396

Frequently Asked Questions

What is the IUPAC name of 5-ethyl-N-pentyl-1,2-oxazole-3-carboxamide?
The IUPAC name of 5-ethyl-N-pentyl-1,2-oxazole-3-carboxamide (CID 160831155) is 5-ethyl-N-pentyl-1,2-oxazole-3-carboxamide.
What is the SMILES notation for 5-ethyl-N-pentyl-1,2-oxazole-3-carboxamide?
The canonical SMILES for 5-ethyl-N-pentyl-1,2-oxazole-3-carboxamide is CCCCCNC(=O)c1cc(CC)on1.
What is the InChIKey of 5-ethyl-N-pentyl-1,2-oxazole-3-carboxamide?
The InChIKey is ADSMCHVNMLUBED-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2O2/c1-3-5-6-7-12-11(14)10-8-9(4-2)15-13-10/h8H,3-7H2,1-2H3,(H,12,14).
What are the key properties of 5-ethyl-N-pentyl-1,2-oxazole-3-carboxamide?
5-ethyl-N-pentyl-1,2-oxazole-3-carboxamide has a molecular weight of 210.28 g/mol, XLogP of 2.16, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-N-pentyl-1,2-oxazole-3-carboxamide is sourced from PubChem (CID 160831155), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).