N-(3,4-dimethylphenyl)-2-morpholin-4-ylacetamide

C14H20N2O2 — CID 856321

IUPACN-(3,4-dimethylphenyl)-2-morpholin-4-ylacetamide
SMILESCc1ccc(NC(=O)CN2CCOCC2)cc1C
InChIInChI=1S/C14H20N2O2/c1-11-3-4-13(9-12(11)2)15-14(17)10-16-5-7-18-8-6-16/h3-4,9H,5-8,10H2,1-2H3,(H,15,17)
InChIKeyIOFZANGNYWGGJN-UHFFFAOYSA-N
MW248.33 g/mol
LogP1.57
Rot. Bonds3

About N-(3,4-dimethylphenyl)-2-morpholin-4-ylacetamide

N-(3,4-dimethylphenyl)-2-morpholin-4-ylacetamide (PubChem CID 856321) has the molecular formula C14H20N2O2 and a molecular weight of 248.33 g/mol. Its IUPAC name is N-(3,4-dimethylphenyl)-2-morpholin-4-ylacetamide.

Molecular Properties

Compound NameN-(3,4-dimethylphenyl)-2-morpholin-4-ylacetamide
PubChem CID856321
Molecular FormulaC14H20N2O2
Molecular Weight248.33 g/mol
Exact Mass248.15
IUPAC NameN-(3,4-dimethylphenyl)-2-morpholin-4-ylacetamide
SMILESCc1ccc(NC(=O)CN2CCOCC2)cc1C
InChIInChI=1S/C14H20N2O2/c1-11-3-4-13(9-12(11)2)15-14(17)10-16-5-7-18-8-6-16/h3-4,9H,5-8,10H2,1-2H3,(H,15,17)
InChIKeyIOFZANGNYWGGJN-UHFFFAOYSA-N
XLogP1.57
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.33
LogP ≤ 51.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(3,4-dimethylphenyl)-2-morpholin-4-ylacetamide?
The IUPAC name of N-(3,4-dimethylphenyl)-2-morpholin-4-ylacetamide (CID 856321) is N-(3,4-dimethylphenyl)-2-morpholin-4-ylacetamide.
What is the SMILES notation for N-(3,4-dimethylphenyl)-2-morpholin-4-ylacetamide?
The canonical SMILES for N-(3,4-dimethylphenyl)-2-morpholin-4-ylacetamide is Cc1ccc(NC(=O)CN2CCOCC2)cc1C.
What is the InChIKey of N-(3,4-dimethylphenyl)-2-morpholin-4-ylacetamide?
The InChIKey is IOFZANGNYWGGJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O2/c1-11-3-4-13(9-12(11)2)15-14(17)10-16-5-7-18-8-6-16/h3-4,9H,5-8,10H2,1-2H3,(H,15,17).
What are the key properties of N-(3,4-dimethylphenyl)-2-morpholin-4-ylacetamide?
N-(3,4-dimethylphenyl)-2-morpholin-4-ylacetamide has a molecular weight of 248.33 g/mol, XLogP of 1.57, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,4-dimethylphenyl)-2-morpholin-4-ylacetamide is sourced from PubChem (CID 856321), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).