3,4-dimethyl-N-(2-morpholin-4-ylethyl)benzamide

C15H22N2O2 — CID 1105927

IUPAC3,4-dimethyl-N-(2-morpholin-4-ylethyl)benzamide
SMILESCc1ccc(C(=O)NCCN2CCOCC2)cc1C
InChIInChI=1S/C15H22N2O2/c1-12-3-4-14(11-13(12)2)15(18)16-5-6-17-7-9-19-10-8-17/h3-4,11H,5-10H2,1-2H3,(H,16,18)
InChIKeyJARXPMHUNKHLNV-UHFFFAOYSA-N
MW262.35 g/mol
LogP1.37
Rot. Bonds4

About 3,4-dimethyl-N-(2-morpholin-4-ylethyl)benzamide

3,4-dimethyl-N-(2-morpholin-4-ylethyl)benzamide (PubChem CID 1105927) has the molecular formula C15H22N2O2 and a molecular weight of 262.35 g/mol. Its IUPAC name is 3,4-dimethyl-N-(2-morpholin-4-ylethyl)benzamide.

Molecular Properties

Compound Name3,4-dimethyl-N-(2-morpholin-4-ylethyl)benzamide
PubChem CID1105927
Molecular FormulaC15H22N2O2
Molecular Weight262.35 g/mol
Exact Mass262.17
IUPAC Name3,4-dimethyl-N-(2-morpholin-4-ylethyl)benzamide
SMILESCc1ccc(C(=O)NCCN2CCOCC2)cc1C
InChIInChI=1S/C15H22N2O2/c1-12-3-4-14(11-13(12)2)15(18)16-5-6-17-7-9-19-10-8-17/h3-4,11H,5-10H2,1-2H3,(H,16,18)
InChIKeyJARXPMHUNKHLNV-UHFFFAOYSA-N
XLogP1.37
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.35
LogP ≤ 51.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3,4-dimethyl-N-(2-morpholin-4-ylethyl)benzamide?
The IUPAC name of 3,4-dimethyl-N-(2-morpholin-4-ylethyl)benzamide (CID 1105927) is 3,4-dimethyl-N-(2-morpholin-4-ylethyl)benzamide.
What is the SMILES notation for 3,4-dimethyl-N-(2-morpholin-4-ylethyl)benzamide?
The canonical SMILES for 3,4-dimethyl-N-(2-morpholin-4-ylethyl)benzamide is Cc1ccc(C(=O)NCCN2CCOCC2)cc1C.
What is the InChIKey of 3,4-dimethyl-N-(2-morpholin-4-ylethyl)benzamide?
The InChIKey is JARXPMHUNKHLNV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O2/c1-12-3-4-14(11-13(12)2)15(18)16-5-6-17-7-9-19-10-8-17/h3-4,11H,5-10H2,1-2H3,(H,16,18).
What are the key properties of 3,4-dimethyl-N-(2-morpholin-4-ylethyl)benzamide?
3,4-dimethyl-N-(2-morpholin-4-ylethyl)benzamide has a molecular weight of 262.35 g/mol, XLogP of 1.37, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3,4-dimethyl-N-(2-morpholin-4-ylethyl)benzamide is sourced from PubChem (CID 1105927), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).