3,5-dimethoxy-N-morpholin-4-ylbenzamide

C13H18N2O4 — CID 4215570

IUPAC3,5-dimethoxy-N-morpholin-4-ylbenzamide
SMILESCOc1cc(OC)cc(C(=O)NN2CCOCC2)c1
InChIInChI=1S/C13H18N2O4/c1-17-11-7-10(8-12(9-11)18-2)13(16)14-15-3-5-19-6-4-15/h7-9H,3-6H2,1-2H3,(H,14,16)
InChIKeyHOVGWTWFAAIWJS-UHFFFAOYSA-N
MW266.30 g/mol
LogP0.68
Rot. Bonds4

About 3,5-dimethoxy-N-morpholin-4-ylbenzamide

3,5-dimethoxy-N-morpholin-4-ylbenzamide (PubChem CID 4215570) has the molecular formula C13H18N2O4 and a molecular weight of 266.30 g/mol. Its IUPAC name is 3,5-dimethoxy-N-morpholin-4-ylbenzamide.

Molecular Properties

Compound Name3,5-dimethoxy-N-morpholin-4-ylbenzamide
PubChem CID4215570
Molecular FormulaC13H18N2O4
Molecular Weight266.30 g/mol
Exact Mass266.13
IUPAC Name3,5-dimethoxy-N-morpholin-4-ylbenzamide
SMILESCOc1cc(OC)cc(C(=O)NN2CCOCC2)c1
InChIInChI=1S/C13H18N2O4/c1-17-11-7-10(8-12(9-11)18-2)13(16)14-15-3-5-19-6-4-15/h7-9H,3-6H2,1-2H3,(H,14,16)
InChIKeyHOVGWTWFAAIWJS-UHFFFAOYSA-N
XLogP0.68
TPSA60.03 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.30
LogP ≤ 50.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3,5-Dimethoxybenzohydrazide
CID 352312
3,5-dimethoxy-N'-(3-phenylpropanoyl)benzohydrazide
CID 846324
N'-(cyclopentanecarbonyl)-3,5-dimethoxybenzohydrazide
CID 5134175
3-methoxy-N-morpholin-4-ylbenzamide
CID 903533
2,6-dimethoxy-N-piperidin-1-ylbenzamide
CID 877820
3,5-dimethoxy-N-(2-oxo-2-piperidin-1-ylethyl)benzamide
CID 2097349
3,5-dimethoxy-N-(3-morpholin-4-ylpropyl)benzamide
CID 2163734
3,5-dimethoxy-N-(2-phenoxyethyl)benzamide
CID 2173139
Ethyl 2-[(3,5-dimethoxyphenyl)formamido]acetate
CID 3118688
3,4,5-triethoxy-N-4-morpholinylbenzamide
CID 868312
3,5-dimethoxy-N-[(1-morpholin-4-ylcyclohexyl)methyl]benzamide
CID 2469885
3,5-dimethoxy-N-(1-methoxypropan-2-yl)benzamide
CID 2878092

Frequently Asked Questions

What is the IUPAC name of 3,5-dimethoxy-N-morpholin-4-ylbenzamide?
The IUPAC name of 3,5-dimethoxy-N-morpholin-4-ylbenzamide (CID 4215570) is 3,5-dimethoxy-N-morpholin-4-ylbenzamide.
What is the SMILES notation for 3,5-dimethoxy-N-morpholin-4-ylbenzamide?
The canonical SMILES for 3,5-dimethoxy-N-morpholin-4-ylbenzamide is COc1cc(OC)cc(C(=O)NN2CCOCC2)c1.
What is the InChIKey of 3,5-dimethoxy-N-morpholin-4-ylbenzamide?
The InChIKey is HOVGWTWFAAIWJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N2O4/c1-17-11-7-10(8-12(9-11)18-2)13(16)14-15-3-5-19-6-4-15/h7-9H,3-6H2,1-2H3,(H,14,16).
What are the key properties of 3,5-dimethoxy-N-morpholin-4-ylbenzamide?
3,5-dimethoxy-N-morpholin-4-ylbenzamide has a molecular weight of 266.30 g/mol, XLogP of 0.68, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dimethoxy-N-morpholin-4-ylbenzamide is sourced from PubChem (CID 4215570), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).