3-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(6-propan-2-yloxy-3-pyridinyl)propanamide

C16H21N3O3 — CID 75461759

IUPAC3-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(6-propan-2-yloxy-3-pyridinyl)propanamide
SMILESCc1noc(C)c1CCC(=O)Nc1ccc(OC(C)C)nc1
InChIInChI=1S/C16H21N3O3/c1-10(2)21-16-8-5-13(9-17-16)18-15(20)7-6-14-11(3)19-22-12(14)4/h5,8-10H,6-7H2,1-4H3,(H,18,20)
InChIKeyVJYVLENDABLUEY-UHFFFAOYSA-N
MW303.36 g/mol
LogP3.04
Rot. Bonds6

About 3-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(6-propan-2-yloxy-3-pyridinyl)propanamide

3-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(6-propan-2-yloxy-3-pyridinyl)propanamide (PubChem CID 75461759) has the molecular formula C16H21N3O3 and a molecular weight of 303.36 g/mol. Its IUPAC name is 3-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(6-propan-2-yloxy-3-pyridinyl)propanamide.

Molecular Properties

Compound Name3-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(6-propan-2-yloxy-3-pyridinyl)propanamide
PubChem CID75461759
Molecular FormulaC16H21N3O3
Molecular Weight303.36 g/mol
Exact Mass303.16
IUPAC Name3-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(6-propan-2-yloxy-3-pyridinyl)propanamide
SMILESCc1noc(C)c1CCC(=O)Nc1ccc(OC(C)C)nc1
InChIInChI=1S/C16H21N3O3/c1-10(2)21-16-8-5-13(9-17-16)18-15(20)7-6-14-11(3)19-22-12(14)4/h5,8-10H,6-7H2,1-4H3,(H,18,20)
InChIKeyVJYVLENDABLUEY-UHFFFAOYSA-N
XLogP3.04
TPSA77.25 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms22
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.36
LogP ≤ 53.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 3-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(6-propan-2-yloxy-3-pyridinyl)propanamide?
The IUPAC name of 3-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(6-propan-2-yloxy-3-pyridinyl)propanamide (CID 75461759) is 3-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(6-propan-2-yloxy-3-pyridinyl)propanamide.
What is the SMILES notation for 3-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(6-propan-2-yloxy-3-pyridinyl)propanamide?
The canonical SMILES for 3-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(6-propan-2-yloxy-3-pyridinyl)propanamide is Cc1noc(C)c1CCC(=O)Nc1ccc(OC(C)C)nc1.
What is the InChIKey of 3-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(6-propan-2-yloxy-3-pyridinyl)propanamide?
The InChIKey is VJYVLENDABLUEY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21N3O3/c1-10(2)21-16-8-5-13(9-17-16)18-15(20)7-6-14-11(3)19-22-12(14)4/h5,8-10H,6-7H2,1-4H3,(H,18,20).
What are the key properties of 3-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(6-propan-2-yloxy-3-pyridinyl)propanamide?
3-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(6-propan-2-yloxy-3-pyridinyl)propanamide has a molecular weight of 303.36 g/mol, XLogP of 3.04, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(6-propan-2-yloxy-3-pyridinyl)propanamide is sourced from PubChem (CID 75461759), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).