N-propyl-1,3-oxazole-4-carboxamide

C7H10N2O2 — CID 110689447

IUPACN-propyl-1,3-oxazole-4-carboxamide
SMILESCCCNC(=O)c1cocn1
InChIInChI=1S/C7H10N2O2/c1-2-3-8-7(10)6-4-11-5-9-6/h4-5H,2-3H2,1H3,(H,8,10)
InChIKeyJSBGXRSZEBLALU-UHFFFAOYSA-N
MW154.17 g/mol
LogP0.81
Rot. Bonds3

About N-propyl-1,3-oxazole-4-carboxamide

N-propyl-1,3-oxazole-4-carboxamide (PubChem CID 110689447) has the molecular formula C7H10N2O2 and a molecular weight of 154.17 g/mol. Its IUPAC name is N-propyl-1,3-oxazole-4-carboxamide.

Molecular Properties

Compound NameN-propyl-1,3-oxazole-4-carboxamide
PubChem CID110689447
Molecular FormulaC7H10N2O2
Molecular Weight154.17 g/mol
Exact Mass154.07
IUPAC NameN-propyl-1,3-oxazole-4-carboxamide
SMILESCCCNC(=O)c1cocn1
InChIInChI=1S/C7H10N2O2/c1-2-3-8-7(10)6-4-11-5-9-6/h4-5H,2-3H2,1H3,(H,8,10)
InChIKeyJSBGXRSZEBLALU-UHFFFAOYSA-N
XLogP0.81
TPSA55.13 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
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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Related Compounds

2-(1,3-oxazol-4-yl)-N-propylacetamide
CID 110686223
N-ethoxy-1,3-oxazole-4-carboxamide
CID 130637813
N-(2-morpholin-4-ylethyl)-1,3-oxazole-4-carboxamide
CID 110689462
1-(1,3-oxazol-4-ylmethyl)-3-propylurea
CID 110747870
N-[(2-fluorophenyl)methyl]-1,3-oxazole-4-carboxamide
CID 110689474
N-(2,6-diethylphenyl)-1,3-oxazole-4-carboxamide
CID 110689557
N-cyclopentyl-1,3-oxazole-4-carboxamide
CID 110689453
5-methyl-N-propylpyrazine-2-carboxamide
CID 60637750
ethane;molecular hydrogen;N-phenyl-1,3-oxazole-4-carboxamide;propane
CID 145236697
N-propylpyrimidine-4-carboxamide
CID 89156251
6-methyl-N-propylpyrimidine-4-carboxamide
CID 110847771
N,N-dimethyl-1,3-oxazole-4-carboxamide;hydrochloride
CID 146272451

Frequently Asked Questions

What is the IUPAC name of N-propyl-1,3-oxazole-4-carboxamide?
The IUPAC name of N-propyl-1,3-oxazole-4-carboxamide (CID 110689447) is N-propyl-1,3-oxazole-4-carboxamide.
What is the SMILES notation for N-propyl-1,3-oxazole-4-carboxamide?
The canonical SMILES for N-propyl-1,3-oxazole-4-carboxamide is CCCNC(=O)c1cocn1.
What is the InChIKey of N-propyl-1,3-oxazole-4-carboxamide?
The InChIKey is JSBGXRSZEBLALU-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10N2O2/c1-2-3-8-7(10)6-4-11-5-9-6/h4-5H,2-3H2,1H3,(H,8,10).
What are the key properties of N-propyl-1,3-oxazole-4-carboxamide?
N-propyl-1,3-oxazole-4-carboxamide has a molecular weight of 154.17 g/mol, XLogP of 0.81, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-propyl-1,3-oxazole-4-carboxamide is sourced from PubChem (CID 110689447), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).