3-(dimethylamino)-N-[(2,4-dimethyl-1,3-oxazol-5-yl)methyl]benzamide

C15H19N3O2 — CID 110742450

IUPAC3-(dimethylamino)-N-[(2,4-dimethyl-1,3-oxazol-5-yl)methyl]benzamide
SMILESCc1nc(C)c(CNC(=O)c2cccc(N(C)C)c2)o1
InChIInChI=1S/C15H19N3O2/c1-10-14(20-11(2)17-10)9-16-15(19)12-6-5-7-13(8-12)18(3)4/h5-8H,9H2,1-4H3,(H,16,19)
InChIKeyHIKIKZCUSGOFHC-UHFFFAOYSA-N
MW273.34 g/mol
LogP2.29
Rot. Bonds4

About 3-(dimethylamino)-N-[(2,4-dimethyl-1,3-oxazol-5-yl)methyl]benzamide

3-(dimethylamino)-N-[(2,4-dimethyl-1,3-oxazol-5-yl)methyl]benzamide (PubChem CID 110742450) has the molecular formula C15H19N3O2 and a molecular weight of 273.34 g/mol. Its IUPAC name is 3-(dimethylamino)-N-[(2,4-dimethyl-1,3-oxazol-5-yl)methyl]benzamide.

Molecular Properties

Compound Name3-(dimethylamino)-N-[(2,4-dimethyl-1,3-oxazol-5-yl)methyl]benzamide
PubChem CID110742450
Molecular FormulaC15H19N3O2
Molecular Weight273.34 g/mol
Exact Mass273.15
IUPAC Name3-(dimethylamino)-N-[(2,4-dimethyl-1,3-oxazol-5-yl)methyl]benzamide
SMILESCc1nc(C)c(CNC(=O)c2cccc(N(C)C)c2)o1
InChIInChI=1S/C15H19N3O2/c1-10-14(20-11(2)17-10)9-16-15(19)12-6-5-7-13(8-12)18(3)4/h5-8H,9H2,1-4H3,(H,16,19)
InChIKeyHIKIKZCUSGOFHC-UHFFFAOYSA-N
XLogP2.29
TPSA58.37 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.34
LogP ≤ 52.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

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N-[(3-chlorophenyl)methyl]-3-(dimethylamino)benzamide
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3-(dimethylamino)-N-[(1-methylpyrazol-4-yl)methyl]benzamide
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3-(dimethylamino)-N-[(6-methyl-2-pyrrolidin-1-ylpyrimidin-4-yl)methyl]benzamide
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CID 66006240

Frequently Asked Questions

What is the IUPAC name of 3-(dimethylamino)-N-[(2,4-dimethyl-1,3-oxazol-5-yl)methyl]benzamide?
The IUPAC name of 3-(dimethylamino)-N-[(2,4-dimethyl-1,3-oxazol-5-yl)methyl]benzamide (CID 110742450) is 3-(dimethylamino)-N-[(2,4-dimethyl-1,3-oxazol-5-yl)methyl]benzamide.
What is the SMILES notation for 3-(dimethylamino)-N-[(2,4-dimethyl-1,3-oxazol-5-yl)methyl]benzamide?
The canonical SMILES for 3-(dimethylamino)-N-[(2,4-dimethyl-1,3-oxazol-5-yl)methyl]benzamide is Cc1nc(C)c(CNC(=O)c2cccc(N(C)C)c2)o1.
What is the InChIKey of 3-(dimethylamino)-N-[(2,4-dimethyl-1,3-oxazol-5-yl)methyl]benzamide?
The InChIKey is HIKIKZCUSGOFHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O2/c1-10-14(20-11(2)17-10)9-16-15(19)12-6-5-7-13(8-12)18(3)4/h5-8H,9H2,1-4H3,(H,16,19).
What are the key properties of 3-(dimethylamino)-N-[(2,4-dimethyl-1,3-oxazol-5-yl)methyl]benzamide?
3-(dimethylamino)-N-[(2,4-dimethyl-1,3-oxazol-5-yl)methyl]benzamide has a molecular weight of 273.34 g/mol, XLogP of 2.29, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(dimethylamino)-N-[(2,4-dimethyl-1,3-oxazol-5-yl)methyl]benzamide is sourced from PubChem (CID 110742450), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).