4-[[1-[(2,4-dichlorophenyl)methyl]benzimidazol-2-yl]methyl]morpholine

C19H19Cl2N3O — CID 6494343

IUPAC4-[[1-[(2,4-dichlorophenyl)methyl]benzimidazol-2-yl]methyl]morpholine
SMILESClc1ccc(Cn2c(CN3CCOCC3)nc3ccccc32)c(Cl)c1
InChIInChI=1S/C19H19Cl2N3O/c20-15-6-5-14(16(21)11-15)12-24-18-4-2-1-3-17(18)22-19(24)13-23-7-9-25-10-8-23/h1-6,11H,7-10,12-13H2
InChIKeySZGYGJQJLKZQLJ-UHFFFAOYSA-N
MW376.29 g/mol
LogP4.22
Rot. Bonds4

About 4-[[1-[(2,4-dichlorophenyl)methyl]benzimidazol-2-yl]methyl]morpholine

4-[[1-[(2,4-dichlorophenyl)methyl]benzimidazol-2-yl]methyl]morpholine (PubChem CID 6494343) has the molecular formula C19H19Cl2N3O and a molecular weight of 376.29 g/mol. Its IUPAC name is 4-[[1-[(2,4-dichlorophenyl)methyl]benzimidazol-2-yl]methyl]morpholine.

Molecular Properties

Compound Name4-[[1-[(2,4-dichlorophenyl)methyl]benzimidazol-2-yl]methyl]morpholine
PubChem CID6494343
Molecular FormulaC19H19Cl2N3O
Molecular Weight376.29 g/mol
Exact Mass375.09
IUPAC Name4-[[1-[(2,4-dichlorophenyl)methyl]benzimidazol-2-yl]methyl]morpholine
SMILESClc1ccc(Cn2c(CN3CCOCC3)nc3ccccc32)c(Cl)c1
InChIInChI=1S/C19H19Cl2N3O/c20-15-6-5-14(16(21)11-15)12-24-18-4-2-1-3-17(18)22-19(24)13-23-7-9-25-10-8-23/h1-6,11H,7-10,12-13H2
InChIKeySZGYGJQJLKZQLJ-UHFFFAOYSA-N
XLogP4.22
TPSA30.29 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.29
LogP ≤ 54.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

4-[[1-[(2,6-dichlorophenyl)methyl]benzimidazol-2-yl]methyl]morpholine
CID 6494342
1-[(2-chlorophenyl)methyl]-2-(pyrrolidin-1-ylmethyl)benzimidazole;trihydrochloride
CID 90664622
2-(azepan-1-ylmethyl)-1-[(2-chlorophenyl)methyl]benzimidazole
CID 18885363
4-[3-[1-[(4-chlorophenyl)methyl]benzimidazol-2-yl]propyl]morpholine
CID 18885480
2-[(4-chlorophenoxy)methyl]-1-[(2,4-dichlorophenyl)methyl]benzimidazole
CID 3789114
1-[(4-chlorophenyl)methyl]-2-(pyrrolidin-1-ylmethyl)benzimidazole;hydroiodide
CID 134350366
N-[3-[1-[(2,4-dichlorophenyl)methyl]benzimidazol-2-yl]propyl]formamide
CID 4886388
1-[(3-chlorophenyl)methyl]-2-(pyrrolidin-1-ylmethyl)benzimidazole;trihydrochloride
CID 90665116
4-[[1-(3-phenylpropyl)benzimidazol-2-yl]methyl]morpholine
CID 16805688
4-[[1-(4-chlorophenyl)sulfonylbenzimidazol-2-yl]methyl]morpholine
CID 43813836
N-[[1-[(2,4-dichlorophenyl)methyl]benzimidazol-2-yl]methyl]propanamide
CID 1293138
4-[[1-[(3-nitrophenyl)methyl]benzimidazol-2-yl]methyl]morpholine
CID 67262100

Frequently Asked Questions

What is the IUPAC name of 4-[[1-[(2,4-dichlorophenyl)methyl]benzimidazol-2-yl]methyl]morpholine?
The IUPAC name of 4-[[1-[(2,4-dichlorophenyl)methyl]benzimidazol-2-yl]methyl]morpholine (CID 6494343) is 4-[[1-[(2,4-dichlorophenyl)methyl]benzimidazol-2-yl]methyl]morpholine.
What is the SMILES notation for 4-[[1-[(2,4-dichlorophenyl)methyl]benzimidazol-2-yl]methyl]morpholine?
The canonical SMILES for 4-[[1-[(2,4-dichlorophenyl)methyl]benzimidazol-2-yl]methyl]morpholine is Clc1ccc(Cn2c(CN3CCOCC3)nc3ccccc32)c(Cl)c1.
What is the InChIKey of 4-[[1-[(2,4-dichlorophenyl)methyl]benzimidazol-2-yl]methyl]morpholine?
The InChIKey is SZGYGJQJLKZQLJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19Cl2N3O/c20-15-6-5-14(16(21)11-15)12-24-18-4-2-1-3-17(18)22-19(24)13-23-7-9-25-10-8-23/h1-6,11H,7-10,12-13H2.
What are the key properties of 4-[[1-[(2,4-dichlorophenyl)methyl]benzimidazol-2-yl]methyl]morpholine?
4-[[1-[(2,4-dichlorophenyl)methyl]benzimidazol-2-yl]methyl]morpholine has a molecular weight of 376.29 g/mol, XLogP of 4.22, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[1-[(2,4-dichlorophenyl)methyl]benzimidazol-2-yl]methyl]morpholine is sourced from PubChem (CID 6494343), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).