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

C15H22N2O4 — CID 754509

IUPAC3,4-dimethoxy-N-(2-morpholin-4-ylethyl)benzamide
SMILESCOc1ccc(C(=O)NCCN2CCOCC2)cc1OC
InChIInChI=1S/C15H22N2O4/c1-19-13-4-3-12(11-14(13)20-2)15(18)16-5-6-17-7-9-21-10-8-17/h3-4,11H,5-10H2,1-2H3,(H,16,18)
InChIKeyNGZWQILSWMJPKG-UHFFFAOYSA-N
MW294.35 g/mol
LogP0.77
Rot. Bonds6

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

3,4-dimethoxy-N-(2-morpholin-4-ylethyl)benzamide (PubChem CID 754509) has the molecular formula C15H22N2O4 and a molecular weight of 294.35 g/mol. Its IUPAC name is 3,4-dimethoxy-N-(2-morpholin-4-ylethyl)benzamide.

Molecular Properties

Compound Name3,4-dimethoxy-N-(2-morpholin-4-ylethyl)benzamide
PubChem CID754509
Molecular FormulaC15H22N2O4
Molecular Weight294.35 g/mol
Exact Mass294.16
IUPAC Name3,4-dimethoxy-N-(2-morpholin-4-ylethyl)benzamide
SMILESCOc1ccc(C(=O)NCCN2CCOCC2)cc1OC
InChIInChI=1S/C15H22N2O4/c1-19-13-4-3-12(11-14(13)20-2)15(18)16-5-6-17-7-9-21-10-8-17/h3-4,11H,5-10H2,1-2H3,(H,16,18)
InChIKeyNGZWQILSWMJPKG-UHFFFAOYSA-N
XLogP0.77
TPSA60.03 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.35
LogP ≤ 50.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 3,4-dimethoxy-N-(2-morpholin-4-ylethyl)benzamide?
The IUPAC name of 3,4-dimethoxy-N-(2-morpholin-4-ylethyl)benzamide (CID 754509) is 3,4-dimethoxy-N-(2-morpholin-4-ylethyl)benzamide.
What is the SMILES notation for 3,4-dimethoxy-N-(2-morpholin-4-ylethyl)benzamide?
The canonical SMILES for 3,4-dimethoxy-N-(2-morpholin-4-ylethyl)benzamide is COc1ccc(C(=O)NCCN2CCOCC2)cc1OC.
What is the InChIKey of 3,4-dimethoxy-N-(2-morpholin-4-ylethyl)benzamide?
The InChIKey is NGZWQILSWMJPKG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O4/c1-19-13-4-3-12(11-14(13)20-2)15(18)16-5-6-17-7-9-21-10-8-17/h3-4,11H,5-10H2,1-2H3,(H,16,18).
What are the key properties of 3,4-dimethoxy-N-(2-morpholin-4-ylethyl)benzamide?
3,4-dimethoxy-N-(2-morpholin-4-ylethyl)benzamide has a molecular weight of 294.35 g/mol, XLogP of 0.77, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3,4-dimethoxy-N-(2-morpholin-4-ylethyl)benzamide is sourced from PubChem (CID 754509), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).