N,N-diethyl-4-[morpholin-4-yl(phenyl)methyl]benzamide

C22H28N2O2 — CID 10498207

IUPACN,N-diethyl-4-[morpholin-4-yl(phenyl)methyl]benzamide
SMILESCCN(CC)C(=O)c1ccc(C(c2ccccc2)N2CCOCC2)cc1
InChIInChI=1S/C22H28N2O2/c1-3-23(4-2)22(25)20-12-10-19(11-13-20)21(18-8-6-5-7-9-18)24-14-16-26-17-15-24/h5-13,21H,3-4,14-17H2,1-2H3
InChIKeyHXDJHYKSRHALMQ-UHFFFAOYSA-N
MW352.48 g/mol
LogP3.59
Rot. Bonds6

About N,N-diethyl-4-[morpholin-4-yl(phenyl)methyl]benzamide

N,N-diethyl-4-[morpholin-4-yl(phenyl)methyl]benzamide (PubChem CID 10498207) has the molecular formula C22H28N2O2 and a molecular weight of 352.48 g/mol. Its IUPAC name is N,N-diethyl-4-[morpholin-4-yl(phenyl)methyl]benzamide.

Molecular Properties

Compound NameN,N-diethyl-4-[morpholin-4-yl(phenyl)methyl]benzamide
PubChem CID10498207
Molecular FormulaC22H28N2O2
Molecular Weight352.48 g/mol
Exact Mass352.22
IUPAC NameN,N-diethyl-4-[morpholin-4-yl(phenyl)methyl]benzamide
SMILESCCN(CC)C(=O)c1ccc(C(c2ccccc2)N2CCOCC2)cc1
InChIInChI=1S/C22H28N2O2/c1-3-23(4-2)22(25)20-12-10-19(11-13-20)21(18-8-6-5-7-9-18)24-14-16-26-17-15-24/h5-13,21H,3-4,14-17H2,1-2H3
InChIKeyHXDJHYKSRHALMQ-UHFFFAOYSA-N
XLogP3.59
TPSA32.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.48
LogP ≤ 53.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-4-[morpholin-4-yl(phenyl)methyl]benzamide?
The IUPAC name of N,N-diethyl-4-[morpholin-4-yl(phenyl)methyl]benzamide (CID 10498207) is N,N-diethyl-4-[morpholin-4-yl(phenyl)methyl]benzamide.
What is the SMILES notation for N,N-diethyl-4-[morpholin-4-yl(phenyl)methyl]benzamide?
The canonical SMILES for N,N-diethyl-4-[morpholin-4-yl(phenyl)methyl]benzamide is CCN(CC)C(=O)c1ccc(C(c2ccccc2)N2CCOCC2)cc1.
What is the InChIKey of N,N-diethyl-4-[morpholin-4-yl(phenyl)methyl]benzamide?
The InChIKey is HXDJHYKSRHALMQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H28N2O2/c1-3-23(4-2)22(25)20-12-10-19(11-13-20)21(18-8-6-5-7-9-18)24-14-16-26-17-15-24/h5-13,21H,3-4,14-17H2,1-2H3.
What are the key properties of N,N-diethyl-4-[morpholin-4-yl(phenyl)methyl]benzamide?
N,N-diethyl-4-[morpholin-4-yl(phenyl)methyl]benzamide has a molecular weight of 352.48 g/mol, XLogP of 3.59, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-4-[morpholin-4-yl(phenyl)methyl]benzamide is sourced from PubChem (CID 10498207), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).