N,N-diethyl-2-[(4-morpholin-4-ylbenzoyl)amino]benzamide

C22H27N3O3 — CID 21367636

IUPACN,N-diethyl-2-[(4-morpholin-4-ylbenzoyl)amino]benzamide
SMILESCCN(CC)C(=O)c1ccccc1NC(=O)c1ccc(N2CCOCC2)cc1
InChIInChI=1S/C22H27N3O3/c1-3-24(4-2)22(27)19-7-5-6-8-20(19)23-21(26)17-9-11-18(12-10-17)25-13-15-28-16-14-25/h5-12H,3-4,13-16H2,1-2H3,(H,23,26)
InChIKeyKNAACLVMPFGXIU-UHFFFAOYSA-N
MW381.48 g/mol
LogP3.26
Rot. Bonds6

About N,N-diethyl-2-[(4-morpholin-4-ylbenzoyl)amino]benzamide

N,N-diethyl-2-[(4-morpholin-4-ylbenzoyl)amino]benzamide (PubChem CID 21367636) has the molecular formula C22H27N3O3 and a molecular weight of 381.48 g/mol. Its IUPAC name is N,N-diethyl-2-[(4-morpholin-4-ylbenzoyl)amino]benzamide.

Molecular Properties

Compound NameN,N-diethyl-2-[(4-morpholin-4-ylbenzoyl)amino]benzamide
PubChem CID21367636
Molecular FormulaC22H27N3O3
Molecular Weight381.48 g/mol
Exact Mass381.21
IUPAC NameN,N-diethyl-2-[(4-morpholin-4-ylbenzoyl)amino]benzamide
SMILESCCN(CC)C(=O)c1ccccc1NC(=O)c1ccc(N2CCOCC2)cc1
InChIInChI=1S/C22H27N3O3/c1-3-24(4-2)22(27)19-7-5-6-8-20(19)23-21(26)17-9-11-18(12-10-17)25-13-15-28-16-14-25/h5-12H,3-4,13-16H2,1-2H3,(H,23,26)
InChIKeyKNAACLVMPFGXIU-UHFFFAOYSA-N
XLogP3.26
TPSA61.88 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500381.48
LogP ≤ 53.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-benzamido-N-methyl-N-[(4-morpholin-4-ylphenyl)methyl]benzamide
CID 35603946
N-tert-butyl-2-[(4-morpholin-4-ylbenzoyl)amino]benzamide
CID 21173543
N,N-diethyl-2-[(4-fluorobenzoyl)amino]benzamide
CID 6458358
N,N-diethyl-2-[[4-(1,2,4-triazol-1-yl)benzoyl]amino]benzamide
CID 86835460
2-[(4-piperidin-1-ylbenzoyl)amino]-N-propylbenzamide
CID 21367704
2-[[4-[(carbamoylamino)methyl]benzoyl]amino]-N,N-diethylbenzamide
CID 86835479
N-(2-acetyl-4-morpholin-4-ylphenyl)-4-phenylbenzamide
CID 71711464
4-ethyl-N-(2-morpholin-4-ylphenyl)benzamide
CID 2677776
N,N-diethyl-2-[[4-[(E)-methoxyiminomethyl]benzoyl]amino]benzamide
CID 86835481
N-[2-(1-methyl-6-oxopyridazin-3-yl)phenyl]-4-morpholin-4-ylbenzamide
CID 72717788
N-(2-benzoyl-4-chlorophenyl)-4-morpholin-4-ylbenzamide
CID 21367719
ethyl 2-[(5-morpholin-4-ylpyridine-3-carbonyl)amino]benzoate
CID 109228723

Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-2-[(4-morpholin-4-ylbenzoyl)amino]benzamide?
The IUPAC name of N,N-diethyl-2-[(4-morpholin-4-ylbenzoyl)amino]benzamide (CID 21367636) is N,N-diethyl-2-[(4-morpholin-4-ylbenzoyl)amino]benzamide.
What is the SMILES notation for N,N-diethyl-2-[(4-morpholin-4-ylbenzoyl)amino]benzamide?
The canonical SMILES for N,N-diethyl-2-[(4-morpholin-4-ylbenzoyl)amino]benzamide is CCN(CC)C(=O)c1ccccc1NC(=O)c1ccc(N2CCOCC2)cc1.
What is the InChIKey of N,N-diethyl-2-[(4-morpholin-4-ylbenzoyl)amino]benzamide?
The InChIKey is KNAACLVMPFGXIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H27N3O3/c1-3-24(4-2)22(27)19-7-5-6-8-20(19)23-21(26)17-9-11-18(12-10-17)25-13-15-28-16-14-25/h5-12H,3-4,13-16H2,1-2H3,(H,23,26).
What are the key properties of N,N-diethyl-2-[(4-morpholin-4-ylbenzoyl)amino]benzamide?
N,N-diethyl-2-[(4-morpholin-4-ylbenzoyl)amino]benzamide has a molecular weight of 381.48 g/mol, XLogP of 3.26, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-2-[(4-morpholin-4-ylbenzoyl)amino]benzamide is sourced from PubChem (CID 21367636), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).