N-benzhydryl-3-(morpholin-4-ylmethyl)benzamide

C25H26N2O2 — CID 43908479

IUPACN-benzhydryl-3-(morpholin-4-ylmethyl)benzamide
SMILESO=C(NC(c1ccccc1)c1ccccc1)c1cccc(CN2CCOCC2)c1
InChIInChI=1S/C25H26N2O2/c28-25(23-13-7-8-20(18-23)19-27-14-16-29-17-15-27)26-24(21-9-3-1-4-10-21)22-11-5-2-6-12-22/h1-13,18,24H,14-17,19H2,(H,26,28)
InChIKeyRDOKWDLCWSFFPN-UHFFFAOYSA-N
MW386.50 g/mol
LogP4.04
Rot. Bonds6

About N-benzhydryl-3-(morpholin-4-ylmethyl)benzamide

N-benzhydryl-3-(morpholin-4-ylmethyl)benzamide (PubChem CID 43908479) has the molecular formula C25H26N2O2 and a molecular weight of 386.50 g/mol. Its IUPAC name is N-benzhydryl-3-(morpholin-4-ylmethyl)benzamide.

Molecular Properties

Compound NameN-benzhydryl-3-(morpholin-4-ylmethyl)benzamide
PubChem CID43908479
Molecular FormulaC25H26N2O2
Molecular Weight386.50 g/mol
Exact Mass386.20
IUPAC NameN-benzhydryl-3-(morpholin-4-ylmethyl)benzamide
SMILESO=C(NC(c1ccccc1)c1ccccc1)c1cccc(CN2CCOCC2)c1
InChIInChI=1S/C25H26N2O2/c28-25(23-13-7-8-20(18-23)19-27-14-16-29-17-15-27)26-24(21-9-3-1-4-10-21)22-11-5-2-6-12-22/h1-13,18,24H,14-17,19H2,(H,26,28)
InChIKeyRDOKWDLCWSFFPN-UHFFFAOYSA-N
XLogP4.04
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500386.50
LogP ≤ 54.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-(morpholin-4-ylmethyl)-N-[(2R)-2-phenylpropyl]benzamide
CID 95237190
N-[(1R)-1-(4-methylphenyl)propyl]-3-(morpholin-4-ylmethyl)benzamide
CID 94013067
bis[3-(morpholin-4-ylmethyl)phenyl]methanone
CID 152548032
N-[(1S)-2-morpholin-4-yl-1-phenylethyl]-3-[(2-oxopyrrolidin-1-yl)methyl]benzamide
CID 9150722
N-[2-(methylamino)propyl]-3-(morpholin-4-ylmethyl)benzamide
CID 120827373
N-[cyclopropyl(2,3-dihydro-1,4-benzodioxin-6-yl)methyl]-3-(morpholin-4-ylmethyl)benzamide
CID 56553400
3-(morpholin-4-ylmethyl)-N-[(2R)-1-(2-oxopyrrolidin-1-yl)propan-2-yl]benzamide
CID 95621032
3-(morpholin-4-ylmethyl)-N-pentylbenzamide
CID 92685635
3-[[4-(3,3-diphenylpropyl)piperazin-1-yl]methyl]-N-(1-phenylethyl)benzamide
CID 90761877
3-(morpholin-4-ylmethyl)-N-[2-(trifluoromethyl)phenyl]benzamide
CID 46778635
ethyl 2-benzyl-3-[[3-(morpholin-4-ylmethyl)benzoyl]amino]propanoate
CID 56513208
N-(3,4-dimethylphenyl)-3-(morpholin-4-ylmethyl)benzamide
CID 46769268

Frequently Asked Questions

What is the IUPAC name of N-benzhydryl-3-(morpholin-4-ylmethyl)benzamide?
The IUPAC name of N-benzhydryl-3-(morpholin-4-ylmethyl)benzamide (CID 43908479) is N-benzhydryl-3-(morpholin-4-ylmethyl)benzamide.
What is the SMILES notation for N-benzhydryl-3-(morpholin-4-ylmethyl)benzamide?
The canonical SMILES for N-benzhydryl-3-(morpholin-4-ylmethyl)benzamide is O=C(NC(c1ccccc1)c1ccccc1)c1cccc(CN2CCOCC2)c1.
What is the InChIKey of N-benzhydryl-3-(morpholin-4-ylmethyl)benzamide?
The InChIKey is RDOKWDLCWSFFPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H26N2O2/c28-25(23-13-7-8-20(18-23)19-27-14-16-29-17-15-27)26-24(21-9-3-1-4-10-21)22-11-5-2-6-12-22/h1-13,18,24H,14-17,19H2,(H,26,28).
What are the key properties of N-benzhydryl-3-(morpholin-4-ylmethyl)benzamide?
N-benzhydryl-3-(morpholin-4-ylmethyl)benzamide has a molecular weight of 386.50 g/mol, XLogP of 4.04, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzhydryl-3-(morpholin-4-ylmethyl)benzamide is sourced from PubChem (CID 43908479), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).