N-(3,4-dimethoxyphenyl)-4-(morpholin-4-ylmethyl)benzamide

C20H24N2O4 — CID 1099911

IUPACN-(3,4-dimethoxyphenyl)-4-(morpholin-4-ylmethyl)benzamide
SMILESCOc1ccc(NC(=O)c2ccc(CN3CCOCC3)cc2)cc1OC
InChIInChI=1S/C20H24N2O4/c1-24-18-8-7-17(13-19(18)25-2)21-20(23)16-5-3-15(4-6-16)14-22-9-11-26-12-10-22/h3-8,13H,9-12,14H2,1-2H3,(H,21,23)
InChIKeyWBPFHHFGYPENDX-UHFFFAOYSA-N
MW356.42 g/mol
LogP2.79
Rot. Bonds6

About N-(3,4-dimethoxyphenyl)-4-(morpholin-4-ylmethyl)benzamide

N-(3,4-dimethoxyphenyl)-4-(morpholin-4-ylmethyl)benzamide (PubChem CID 1099911) has the molecular formula C20H24N2O4 and a molecular weight of 356.42 g/mol. Its IUPAC name is N-(3,4-dimethoxyphenyl)-4-(morpholin-4-ylmethyl)benzamide.

Molecular Properties

Compound NameN-(3,4-dimethoxyphenyl)-4-(morpholin-4-ylmethyl)benzamide
PubChem CID1099911
Molecular FormulaC20H24N2O4
Molecular Weight356.42 g/mol
Exact Mass356.17
IUPAC NameN-(3,4-dimethoxyphenyl)-4-(morpholin-4-ylmethyl)benzamide
SMILESCOc1ccc(NC(=O)c2ccc(CN3CCOCC3)cc2)cc1OC
InChIInChI=1S/C20H24N2O4/c1-24-18-8-7-17(13-19(18)25-2)21-20(23)16-5-3-15(4-6-16)14-22-9-11-26-12-10-22/h3-8,13H,9-12,14H2,1-2H3,(H,21,23)
InChIKeyWBPFHHFGYPENDX-UHFFFAOYSA-N
XLogP2.79
TPSA60.03 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.42
LogP ≤ 52.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(3,4-dimethoxyphenyl)-4-[(4-phenylpiperazin-1-yl)methyl]benzamide
CID 1363715
N-(2,5-dimethoxyphenyl)-4-(morpholin-4-ylmethyl)benzamide
CID 1106324
dimethyl 5-[[4-(morpholin-4-ylmethyl)benzoyl]amino]benzene-1,3-dicarboxylate
CID 9045335
N-(4-acetylphenyl)-4-(morpholin-4-ylmethyl)benzamide
CID 5132306
N-[(1R)-1-(3,4-dimethoxyphenyl)ethyl]-4-(morpholin-4-ylmethyl)benzamide
CID 92677739
1-(3,4-dimethoxyphenyl)-2-[[4-(morpholin-4-ylmethyl)phenyl]methyl]guanidine
CID 111033522
N-(3-amino-4-methylphenyl)-4-(morpholin-4-ylmethyl)benzamide
CID 141217445
N-(3,4-dimethoxyphenyl)-4-[(2,4-dioxo-8-oxa-1,3-diazaspiro[4.5]decan-3-yl)methyl]benzamide
CID 91908465
3,4-dimethoxy-N-[4-(2-morpholin-4-ylethylamino)phenyl]benzamide
CID 112981431
2,4-dimethoxy-N-[4-(morpholin-4-ylmethyl)phenyl]benzamide
CID 2996444
4-methyl-N-[4-(1,4-oxazepan-4-ylmethyl)phenyl]benzamide
CID 166858230
N-(3-fluorophenyl)-4-(morpholin-4-ylmethyl)benzamide
CID 674229

Frequently Asked Questions

What is the IUPAC name of N-(3,4-dimethoxyphenyl)-4-(morpholin-4-ylmethyl)benzamide?
The IUPAC name of N-(3,4-dimethoxyphenyl)-4-(morpholin-4-ylmethyl)benzamide (CID 1099911) is N-(3,4-dimethoxyphenyl)-4-(morpholin-4-ylmethyl)benzamide.
What is the SMILES notation for N-(3,4-dimethoxyphenyl)-4-(morpholin-4-ylmethyl)benzamide?
The canonical SMILES for N-(3,4-dimethoxyphenyl)-4-(morpholin-4-ylmethyl)benzamide is COc1ccc(NC(=O)c2ccc(CN3CCOCC3)cc2)cc1OC.
What is the InChIKey of N-(3,4-dimethoxyphenyl)-4-(morpholin-4-ylmethyl)benzamide?
The InChIKey is WBPFHHFGYPENDX-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N2O4/c1-24-18-8-7-17(13-19(18)25-2)21-20(23)16-5-3-15(4-6-16)14-22-9-11-26-12-10-22/h3-8,13H,9-12,14H2,1-2H3,(H,21,23).
What are the key properties of N-(3,4-dimethoxyphenyl)-4-(morpholin-4-ylmethyl)benzamide?
N-(3,4-dimethoxyphenyl)-4-(morpholin-4-ylmethyl)benzamide has a molecular weight of 356.42 g/mol, XLogP of 2.79, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,4-dimethoxyphenyl)-4-(morpholin-4-ylmethyl)benzamide is sourced from PubChem (CID 1099911), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).