N-ethyl-N-phenyl-5-propan-2-yl-1,2-oxazole-3-carboxamide

C15H18N2O2 — CID 110857857

IUPACN-ethyl-N-phenyl-5-propan-2-yl-1,2-oxazole-3-carboxamide
SMILESCCN(C(=O)c1cc(C(C)C)on1)c1ccccc1
InChIInChI=1S/C15H18N2O2/c1-4-17(12-8-6-5-7-9-12)15(18)13-10-14(11(2)3)19-16-13/h5-11H,4H2,1-3H3
InChIKeyALIRVYKNTIKDAF-UHFFFAOYSA-N
MW258.32 g/mol
LogP3.46
Rot. Bonds4

About N-ethyl-N-phenyl-5-propan-2-yl-1,2-oxazole-3-carboxamide

N-ethyl-N-phenyl-5-propan-2-yl-1,2-oxazole-3-carboxamide (PubChem CID 110857857) has the molecular formula C15H18N2O2 and a molecular weight of 258.32 g/mol. Its IUPAC name is N-ethyl-N-phenyl-5-propan-2-yl-1,2-oxazole-3-carboxamide.

Molecular Properties

Compound NameN-ethyl-N-phenyl-5-propan-2-yl-1,2-oxazole-3-carboxamide
PubChem CID110857857
Molecular FormulaC15H18N2O2
Molecular Weight258.32 g/mol
Exact Mass258.14
IUPAC NameN-ethyl-N-phenyl-5-propan-2-yl-1,2-oxazole-3-carboxamide
SMILESCCN(C(=O)c1cc(C(C)C)on1)c1ccccc1
InChIInChI=1S/C15H18N2O2/c1-4-17(12-8-6-5-7-9-12)15(18)13-10-14(11(2)3)19-16-13/h5-11H,4H2,1-3H3
InChIKeyALIRVYKNTIKDAF-UHFFFAOYSA-N
XLogP3.46
TPSA46.34 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.32
LogP ≤ 53.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-benzyl-N-methyl-5-propan-2-yl-1,2-oxazole-3-carboxamide
CID 22427540
N-[(3S)-1-benzylpyrrolidin-3-yl]-N-methyl-5-propan-2-yl-1,2-oxazole-3-carboxamide
CID 124861348
N-ethyl-2-methyl-6-(2-methylpropylamino)-N-phenylpyrimidine-4-carboxamide
CID 109362029
N-ethyl-N,2-diphenyl-6-(propan-2-ylamino)pyrimidine-4-carboxamide
CID 112851537
(2S)-N-ethyl-2-[(S)-(3-methyl-1,2-oxazol-5-yl)methylsulfinyl]-N-phenylpropanamide
CID 95599524
N-ethyl-6-methoxy-N-phenylpyridazine-3-carboxamide
CID 90509364
2-[3-[ethyl(phenyl)carbamoyl]pyrazol-1-yl]acetic acid
CID 19623365
N-ethyl-6-methoxy-N-phenylpyrimidine-4-carboxamide
CID 121167323
N-[3-[ethyl(phenyl)carbamoyl]phenyl]-3-methyl-1,2-oxazole-5-carboxamide
CID 43911446
N-ethyl-3,5-dimethyl-N-phenylbenzamide
CID 134028664
N-ethyl-N-phenyl-5-(1-phenylethylamino)pyridine-2-carboxamide
CID 109189023
N-ethyl-N-phenyl-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine-2-carboxamide
CID 90536815

Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-phenyl-5-propan-2-yl-1,2-oxazole-3-carboxamide?
The IUPAC name of N-ethyl-N-phenyl-5-propan-2-yl-1,2-oxazole-3-carboxamide (CID 110857857) is N-ethyl-N-phenyl-5-propan-2-yl-1,2-oxazole-3-carboxamide.
What is the SMILES notation for N-ethyl-N-phenyl-5-propan-2-yl-1,2-oxazole-3-carboxamide?
The canonical SMILES for N-ethyl-N-phenyl-5-propan-2-yl-1,2-oxazole-3-carboxamide is CCN(C(=O)c1cc(C(C)C)on1)c1ccccc1.
What is the InChIKey of N-ethyl-N-phenyl-5-propan-2-yl-1,2-oxazole-3-carboxamide?
The InChIKey is ALIRVYKNTIKDAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O2/c1-4-17(12-8-6-5-7-9-12)15(18)13-10-14(11(2)3)19-16-13/h5-11H,4H2,1-3H3.
What are the key properties of N-ethyl-N-phenyl-5-propan-2-yl-1,2-oxazole-3-carboxamide?
N-ethyl-N-phenyl-5-propan-2-yl-1,2-oxazole-3-carboxamide has a molecular weight of 258.32 g/mol, XLogP of 3.46, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-phenyl-5-propan-2-yl-1,2-oxazole-3-carboxamide is sourced from PubChem (CID 110857857), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).