2-(3-methyl-1,2-oxazol-5-yl)-N-[(1-methylpyrazol-4-yl)methyl]-N-propan-2-ylacetamide

C14H20N4O2 — CID 56743144

IUPAC2-(3-methyl-1,2-oxazol-5-yl)-N-[(1-methylpyrazol-4-yl)methyl]-N-propan-2-ylacetamide
SMILESCc1cc(CC(=O)N(Cc2cnn(C)c2)C(C)C)on1
InChIInChI=1S/C14H20N4O2/c1-10(2)18(9-12-7-15-17(4)8-12)14(19)6-13-5-11(3)16-20-13/h5,7-8,10H,6,9H2,1-4H3
InChIKeyHWPFXXULIKEVOP-UHFFFAOYSA-N
MW276.34 g/mol
LogP1.70
Rot. Bonds5

About 2-(3-methyl-1,2-oxazol-5-yl)-N-[(1-methylpyrazol-4-yl)methyl]-N-propan-2-ylacetamide

2-(3-methyl-1,2-oxazol-5-yl)-N-[(1-methylpyrazol-4-yl)methyl]-N-propan-2-ylacetamide (PubChem CID 56743144) has the molecular formula C14H20N4O2 and a molecular weight of 276.34 g/mol. Its IUPAC name is 2-(3-methyl-1,2-oxazol-5-yl)-N-[(1-methylpyrazol-4-yl)methyl]-N-propan-2-ylacetamide.

Molecular Properties

Compound Name2-(3-methyl-1,2-oxazol-5-yl)-N-[(1-methylpyrazol-4-yl)methyl]-N-propan-2-ylacetamide
PubChem CID56743144
Molecular FormulaC14H20N4O2
Molecular Weight276.34 g/mol
Exact Mass276.16
IUPAC Name2-(3-methyl-1,2-oxazol-5-yl)-N-[(1-methylpyrazol-4-yl)methyl]-N-propan-2-ylacetamide
SMILESCc1cc(CC(=O)N(Cc2cnn(C)c2)C(C)C)on1
InChIInChI=1S/C14H20N4O2/c1-10(2)18(9-12-7-15-17(4)8-12)14(19)6-13-5-11(3)16-20-13/h5,7-8,10H,6,9H2,1-4H3
InChIKeyHWPFXXULIKEVOP-UHFFFAOYSA-N
XLogP1.70
TPSA64.16 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.34
LogP ≤ 51.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(3-methyl-1,2-oxazol-5-yl)-N-[(1-methylpyrazol-4-yl)methyl]-N-propan-2-ylacetamide?
The IUPAC name of 2-(3-methyl-1,2-oxazol-5-yl)-N-[(1-methylpyrazol-4-yl)methyl]-N-propan-2-ylacetamide (CID 56743144) is 2-(3-methyl-1,2-oxazol-5-yl)-N-[(1-methylpyrazol-4-yl)methyl]-N-propan-2-ylacetamide.
What is the SMILES notation for 2-(3-methyl-1,2-oxazol-5-yl)-N-[(1-methylpyrazol-4-yl)methyl]-N-propan-2-ylacetamide?
The canonical SMILES for 2-(3-methyl-1,2-oxazol-5-yl)-N-[(1-methylpyrazol-4-yl)methyl]-N-propan-2-ylacetamide is Cc1cc(CC(=O)N(Cc2cnn(C)c2)C(C)C)on1.
What is the InChIKey of 2-(3-methyl-1,2-oxazol-5-yl)-N-[(1-methylpyrazol-4-yl)methyl]-N-propan-2-ylacetamide?
The InChIKey is HWPFXXULIKEVOP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N4O2/c1-10(2)18(9-12-7-15-17(4)8-12)14(19)6-13-5-11(3)16-20-13/h5,7-8,10H,6,9H2,1-4H3.
What are the key properties of 2-(3-methyl-1,2-oxazol-5-yl)-N-[(1-methylpyrazol-4-yl)methyl]-N-propan-2-ylacetamide?
2-(3-methyl-1,2-oxazol-5-yl)-N-[(1-methylpyrazol-4-yl)methyl]-N-propan-2-ylacetamide has a molecular weight of 276.34 g/mol, XLogP of 1.70, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-methyl-1,2-oxazol-5-yl)-N-[(1-methylpyrazol-4-yl)methyl]-N-propan-2-ylacetamide is sourced from PubChem (CID 56743144), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).