2-cyclobutyl-5-methyl-N-(1-pyridin-3-ylethyl)-1,3-oxazole-4-carboxamide

C16H19N3O2 — CID 53195342

IUPAC2-cyclobutyl-5-methyl-N-(1-pyridin-3-ylethyl)-1,3-oxazole-4-carboxamide
SMILESCc1oc(C2CCC2)nc1C(=O)NC(C)c1cccnc1
InChIInChI=1S/C16H19N3O2/c1-10(13-7-4-8-17-9-13)18-15(20)14-11(2)21-16(19-14)12-5-3-6-12/h4,7-10,12H,3,5-6H2,1-2H3,(H,18,20)
InChIKeyAJAODCGJAFQVDL-UHFFFAOYSA-N
MW285.35 g/mol
LogP3.14
Rot. Bonds4

About 2-cyclobutyl-5-methyl-N-(1-pyridin-3-ylethyl)-1,3-oxazole-4-carboxamide

2-cyclobutyl-5-methyl-N-(1-pyridin-3-ylethyl)-1,3-oxazole-4-carboxamide (PubChem CID 53195342) has the molecular formula C16H19N3O2 and a molecular weight of 285.35 g/mol. Its IUPAC name is 2-cyclobutyl-5-methyl-N-(1-pyridin-3-ylethyl)-1,3-oxazole-4-carboxamide.

Molecular Properties

Compound Name2-cyclobutyl-5-methyl-N-(1-pyridin-3-ylethyl)-1,3-oxazole-4-carboxamide
PubChem CID53195342
Molecular FormulaC16H19N3O2
Molecular Weight285.35 g/mol
Exact Mass285.15
IUPAC Name2-cyclobutyl-5-methyl-N-(1-pyridin-3-ylethyl)-1,3-oxazole-4-carboxamide
SMILESCc1oc(C2CCC2)nc1C(=O)NC(C)c1cccnc1
InChIInChI=1S/C16H19N3O2/c1-10(13-7-4-8-17-9-13)18-15(20)14-11(2)21-16(19-14)12-5-3-6-12/h4,7-10,12H,3,5-6H2,1-2H3,(H,18,20)
InChIKeyAJAODCGJAFQVDL-UHFFFAOYSA-N
XLogP3.14
TPSA68.02 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.35
LogP ≤ 53.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-cyclobutyl-5-methyl-N-(1-pyridin-3-ylethyl)-1,3-oxazole-4-carboxamide?
The IUPAC name of 2-cyclobutyl-5-methyl-N-(1-pyridin-3-ylethyl)-1,3-oxazole-4-carboxamide (CID 53195342) is 2-cyclobutyl-5-methyl-N-(1-pyridin-3-ylethyl)-1,3-oxazole-4-carboxamide.
What is the SMILES notation for 2-cyclobutyl-5-methyl-N-(1-pyridin-3-ylethyl)-1,3-oxazole-4-carboxamide?
The canonical SMILES for 2-cyclobutyl-5-methyl-N-(1-pyridin-3-ylethyl)-1,3-oxazole-4-carboxamide is Cc1oc(C2CCC2)nc1C(=O)NC(C)c1cccnc1.
What is the InChIKey of 2-cyclobutyl-5-methyl-N-(1-pyridin-3-ylethyl)-1,3-oxazole-4-carboxamide?
The InChIKey is AJAODCGJAFQVDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3O2/c1-10(13-7-4-8-17-9-13)18-15(20)14-11(2)21-16(19-14)12-5-3-6-12/h4,7-10,12H,3,5-6H2,1-2H3,(H,18,20).
What are the key properties of 2-cyclobutyl-5-methyl-N-(1-pyridin-3-ylethyl)-1,3-oxazole-4-carboxamide?
2-cyclobutyl-5-methyl-N-(1-pyridin-3-ylethyl)-1,3-oxazole-4-carboxamide has a molecular weight of 285.35 g/mol, XLogP of 3.14, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclobutyl-5-methyl-N-(1-pyridin-3-ylethyl)-1,3-oxazole-4-carboxamide is sourced from PubChem (CID 53195342), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).