N-propan-2-yl-1,2-oxazole-5-carboxamide

C7H10N2O2 — CID 59232268

IUPACN-propan-2-yl-1,2-oxazole-5-carboxamide
SMILESCC(C)NC(=O)c1ccno1
InChIInChI=1S/C7H10N2O2/c1-5(2)9-7(10)6-3-4-8-11-6/h3-5H,1-2H3,(H,9,10)
InChIKeyPPKPUKDCLXFXCJ-UHFFFAOYSA-N
MW154.17 g/mol
LogP0.81
Rot. Bonds2

About N-propan-2-yl-1,2-oxazole-5-carboxamide

N-propan-2-yl-1,2-oxazole-5-carboxamide (PubChem CID 59232268) has the molecular formula C7H10N2O2 and a molecular weight of 154.17 g/mol. Its IUPAC name is N-propan-2-yl-1,2-oxazole-5-carboxamide.

Molecular Properties

Compound NameN-propan-2-yl-1,2-oxazole-5-carboxamide
PubChem CID59232268
Molecular FormulaC7H10N2O2
Molecular Weight154.17 g/mol
Exact Mass154.07
IUPAC NameN-propan-2-yl-1,2-oxazole-5-carboxamide
SMILESCC(C)NC(=O)c1ccno1
InChIInChI=1S/C7H10N2O2/c1-5(2)9-7(10)6-3-4-8-11-6/h3-5H,1-2H3,(H,9,10)
InChIKeyPPKPUKDCLXFXCJ-UHFFFAOYSA-N
XLogP0.81
TPSA55.13 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.17
LogP ≤ 50.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-propan-2-yl-1,2-oxazole-5-carboxamide?
The IUPAC name of N-propan-2-yl-1,2-oxazole-5-carboxamide (CID 59232268) is N-propan-2-yl-1,2-oxazole-5-carboxamide.
What is the SMILES notation for N-propan-2-yl-1,2-oxazole-5-carboxamide?
The canonical SMILES for N-propan-2-yl-1,2-oxazole-5-carboxamide is CC(C)NC(=O)c1ccno1.
What is the InChIKey of N-propan-2-yl-1,2-oxazole-5-carboxamide?
The InChIKey is PPKPUKDCLXFXCJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10N2O2/c1-5(2)9-7(10)6-3-4-8-11-6/h3-5H,1-2H3,(H,9,10).
What are the key properties of N-propan-2-yl-1,2-oxazole-5-carboxamide?
N-propan-2-yl-1,2-oxazole-5-carboxamide has a molecular weight of 154.17 g/mol, XLogP of 0.81, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-propan-2-yl-1,2-oxazole-5-carboxamide is sourced from PubChem (CID 59232268), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).