N-ethyl-N-phenyl-1,3-oxazole-5-carboxamide

C12H12N2O2 — CID 110857869

IUPACN-ethyl-N-phenyl-1,3-oxazole-5-carboxamide
SMILESCCN(C(=O)c1cnco1)c1ccccc1
InChIInChI=1S/C12H12N2O2/c1-2-14(10-6-4-3-5-7-10)12(15)11-8-13-9-16-11/h3-9H,2H2,1H3
InChIKeyPTCAPRBNIYRNST-UHFFFAOYSA-N
MW216.24 g/mol
LogP2.34
Rot. Bonds3

About N-ethyl-N-phenyl-1,3-oxazole-5-carboxamide

N-ethyl-N-phenyl-1,3-oxazole-5-carboxamide (PubChem CID 110857869) has the molecular formula C12H12N2O2 and a molecular weight of 216.24 g/mol. Its IUPAC name is N-ethyl-N-phenyl-1,3-oxazole-5-carboxamide.

Molecular Properties

Compound NameN-ethyl-N-phenyl-1,3-oxazole-5-carboxamide
PubChem CID110857869
Molecular FormulaC12H12N2O2
Molecular Weight216.24 g/mol
Exact Mass216.09
IUPAC NameN-ethyl-N-phenyl-1,3-oxazole-5-carboxamide
SMILESCCN(C(=O)c1cnco1)c1ccccc1
InChIInChI=1S/C12H12N2O2/c1-2-14(10-6-4-3-5-7-10)12(15)11-8-13-9-16-11/h3-9H,2H2,1H3
InChIKeyPTCAPRBNIYRNST-UHFFFAOYSA-N
XLogP2.34
TPSA46.34 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.24
LogP ≤ 52.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-ethyl-N-(3-methylphenyl)-1,3-oxazole-5-carboxamide
CID 110865014
N-ethyl-3-methyl-N-phenylimidazole-4-carboxamide
CID 42789423
N-ethyl-5-nitro-N-phenylfuran-2-carboxamide
CID 773502
N-ethyl-2-methyl-N-phenylpyrimidine-5-carboxamide
CID 110857873
6-amino-N-ethyl-N-phenylpyrazine-2-carboxamide
CID 114035687
N-ethyl-4-methyl-N-phenylpyrimidine-5-carboxamide
CID 110857874
N-ethyl-5-(N-ethylanilino)-N-phenylpyridine-3-carboxamide
CID 109243544
N-ethyl-5-methyl-N-phenylfuro[3,2-b]pyridine-2-carboxamide
CID 16906958
N,N'-diethyl-N,N'-diphenylpropanediamide
CID 14847934
N-ethyl-3,5-dimethyl-N-phenylbenzamide
CID 134028664
4-(dimethylamino)-N-ethyl-N-phenylbenzamide
CID 110757236
N-ethyl-N,5-diphenyl-1,3,4-oxadiazole-2-carboxamide
CID 110390946

Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-phenyl-1,3-oxazole-5-carboxamide?
The IUPAC name of N-ethyl-N-phenyl-1,3-oxazole-5-carboxamide (CID 110857869) is N-ethyl-N-phenyl-1,3-oxazole-5-carboxamide.
What is the SMILES notation for N-ethyl-N-phenyl-1,3-oxazole-5-carboxamide?
The canonical SMILES for N-ethyl-N-phenyl-1,3-oxazole-5-carboxamide is CCN(C(=O)c1cnco1)c1ccccc1.
What is the InChIKey of N-ethyl-N-phenyl-1,3-oxazole-5-carboxamide?
The InChIKey is PTCAPRBNIYRNST-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12N2O2/c1-2-14(10-6-4-3-5-7-10)12(15)11-8-13-9-16-11/h3-9H,2H2,1H3.
What are the key properties of N-ethyl-N-phenyl-1,3-oxazole-5-carboxamide?
N-ethyl-N-phenyl-1,3-oxazole-5-carboxamide has a molecular weight of 216.24 g/mol, XLogP of 2.34, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-phenyl-1,3-oxazole-5-carboxamide is sourced from PubChem (CID 110857869), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).