3,5-dimethoxy-N-[2-(2-morpholin-4-ylethylamino)-2-oxoethyl]benzamide

C17H25N3O5 — CID 110285157

IUPAC3,5-dimethoxy-N-[2-(2-morpholin-4-ylethylamino)-2-oxoethyl]benzamide
SMILESCOc1cc(OC)cc(C(=O)NCC(=O)NCCN2CCOCC2)c1
InChIInChI=1S/C17H25N3O5/c1-23-14-9-13(10-15(11-14)24-2)17(22)19-12-16(21)18-3-4-20-5-7-25-8-6-20/h9-11H,3-8,12H2,1-2H3,(H,18,21)(H,19,22)
InChIKeyGKFMPHGMVZIXPL-UHFFFAOYSA-N
MW351.40 g/mol
LogP-0.12
Rot. Bonds8

About 3,5-dimethoxy-N-[2-(2-morpholin-4-ylethylamino)-2-oxoethyl]benzamide

3,5-dimethoxy-N-[2-(2-morpholin-4-ylethylamino)-2-oxoethyl]benzamide (PubChem CID 110285157) has the molecular formula C17H25N3O5 and a molecular weight of 351.40 g/mol. Its IUPAC name is 3,5-dimethoxy-N-[2-(2-morpholin-4-ylethylamino)-2-oxoethyl]benzamide.

Molecular Properties

Compound Name3,5-dimethoxy-N-[2-(2-morpholin-4-ylethylamino)-2-oxoethyl]benzamide
PubChem CID110285157
Molecular FormulaC17H25N3O5
Molecular Weight351.40 g/mol
Exact Mass351.18
IUPAC Name3,5-dimethoxy-N-[2-(2-morpholin-4-ylethylamino)-2-oxoethyl]benzamide
SMILESCOc1cc(OC)cc(C(=O)NCC(=O)NCCN2CCOCC2)c1
InChIInChI=1S/C17H25N3O5/c1-23-14-9-13(10-15(11-14)24-2)17(22)19-12-16(21)18-3-4-20-5-7-25-8-6-20/h9-11H,3-8,12H2,1-2H3,(H,18,21)(H,19,22)
InChIKeyGKFMPHGMVZIXPL-UHFFFAOYSA-N
XLogP-0.12
TPSA89.13 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.40
LogP ≤ 5-0.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

3-amino-5-methoxy-N-(2-morpholin-4-ylethyl)benzamide
CID 81090153
4-amino-N-[2-(2-morpholin-4-ylethylamino)-2-oxoethyl]benzamide
CID 119863887
1-(3,5-dimethoxyphenyl)-3-(2-morpholin-4-ylethyl)urea
CID 16645776
3,5-dimethoxy-N-[2-oxo-2-[[2-oxo-2-(propylamino)ethyl]amino]ethyl]benzamide
CID 18162820
3,5-dimethoxy-N-[2-(3-methoxypropylamino)-2-oxoethyl]benzamide
CID 35513841
(E)-3-(3,5-dimethoxyphenyl)-N-(2-morpholin-4-ylethyl)prop-2-enamide
CID 36842232
N-[5-(azepan-1-yl)pentyl]-3,5-dimethoxybenzamide
CID 110444718
4-methoxy-N-(2-morpholin-4-ylethylcarbamoyl)benzamide
CID 23875507
2-(3-methoxypropylamino)-N-(2-morpholin-4-ylethyl)acetamide
CID 108994050
2-morpholin-4-ylethyl 3,5-dimethoxybenzoate
CID 50896866
4-butoxy-N-[2-(4-morpholin-4-ylbutylamino)-2-oxoethyl]benzamide
CID 55848187
2-[(4-methoxy-2-methylphenyl)sulfonylamino]-N-(2-morpholin-4-ylethyl)acetamide
CID 110285223

Frequently Asked Questions

What is the IUPAC name of 3,5-dimethoxy-N-[2-(2-morpholin-4-ylethylamino)-2-oxoethyl]benzamide?
The IUPAC name of 3,5-dimethoxy-N-[2-(2-morpholin-4-ylethylamino)-2-oxoethyl]benzamide (CID 110285157) is 3,5-dimethoxy-N-[2-(2-morpholin-4-ylethylamino)-2-oxoethyl]benzamide.
What is the SMILES notation for 3,5-dimethoxy-N-[2-(2-morpholin-4-ylethylamino)-2-oxoethyl]benzamide?
The canonical SMILES for 3,5-dimethoxy-N-[2-(2-morpholin-4-ylethylamino)-2-oxoethyl]benzamide is COc1cc(OC)cc(C(=O)NCC(=O)NCCN2CCOCC2)c1.
What is the InChIKey of 3,5-dimethoxy-N-[2-(2-morpholin-4-ylethylamino)-2-oxoethyl]benzamide?
The InChIKey is GKFMPHGMVZIXPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25N3O5/c1-23-14-9-13(10-15(11-14)24-2)17(22)19-12-16(21)18-3-4-20-5-7-25-8-6-20/h9-11H,3-8,12H2,1-2H3,(H,18,21)(H,19,22).
What are the key properties of 3,5-dimethoxy-N-[2-(2-morpholin-4-ylethylamino)-2-oxoethyl]benzamide?
3,5-dimethoxy-N-[2-(2-morpholin-4-ylethylamino)-2-oxoethyl]benzamide has a molecular weight of 351.40 g/mol, XLogP of -0.12, 8 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dimethoxy-N-[2-(2-morpholin-4-ylethylamino)-2-oxoethyl]benzamide is sourced from PubChem (CID 110285157), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).