4-(benzimidazol-1-yl)-N-[[4-(morpholin-4-ylmethyl)phenyl]methyl]benzamide

C26H26N4O2 — CID 24549547

IUPAC4-(benzimidazol-1-yl)-N-[[4-(morpholin-4-ylmethyl)phenyl]methyl]benzamide
SMILESO=C(NCc1ccc(CN2CCOCC2)cc1)c1ccc(-n2cnc3ccccc32)cc1
InChIInChI=1S/C26H26N4O2/c31-26(27-17-20-5-7-21(8-6-20)18-29-13-15-32-16-14-29)22-9-11-23(12-10-22)30-19-28-24-3-1-2-4-25(24)30/h1-12,19H,13-18H2,(H,27,31)
InChIKeyHFQFHJBQYSXEOK-UHFFFAOYSA-N
MW426.52 g/mol
LogP3.79
Rot. Bonds6

About 4-(benzimidazol-1-yl)-N-[[4-(morpholin-4-ylmethyl)phenyl]methyl]benzamide

4-(benzimidazol-1-yl)-N-[[4-(morpholin-4-ylmethyl)phenyl]methyl]benzamide (PubChem CID 24549547) has the molecular formula C26H26N4O2 and a molecular weight of 426.52 g/mol. Its IUPAC name is 4-(benzimidazol-1-yl)-N-[[4-(morpholin-4-ylmethyl)phenyl]methyl]benzamide.

Molecular Properties

Compound Name4-(benzimidazol-1-yl)-N-[[4-(morpholin-4-ylmethyl)phenyl]methyl]benzamide
PubChem CID24549547
Molecular FormulaC26H26N4O2
Molecular Weight426.52 g/mol
Exact Mass426.21
IUPAC Name4-(benzimidazol-1-yl)-N-[[4-(morpholin-4-ylmethyl)phenyl]methyl]benzamide
SMILESO=C(NCc1ccc(CN2CCOCC2)cc1)c1ccc(-n2cnc3ccccc32)cc1
InChIInChI=1S/C26H26N4O2/c31-26(27-17-20-5-7-21(8-6-20)18-29-13-15-32-16-14-29)22-9-11-23(12-10-22)30-19-28-24-3-1-2-4-25(24)30/h1-12,19H,13-18H2,(H,27,31)
InChIKeyHFQFHJBQYSXEOK-UHFFFAOYSA-N
XLogP3.79
TPSA59.39 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500426.52
LogP ≤ 53.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

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4-(acetamidomethyl)-N-[4-(benzimidazol-1-yl)phenyl]benzamide
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1-[4-(benzimidazol-1-yl)phenyl]-3-(2-morpholin-4-ylethyl)urea
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N-[[4-(benzimidazol-1-yl)phenyl]methyl]pyrazine-2-carboxamide
CID 49004009
3,4-dimethyl-N-[[4-(morpholin-4-ylmethyl)phenyl]methyl]benzamide
CID 17397484
N-[[4-(2-amino-2-oxoethoxy)-3-methoxyphenyl]methyl]-4-(benzimidazol-1-yl)benzamide
CID 55866271
4-(benzimidazol-1-yl)-N-[(4-hydroxypyrrolidin-3-yl)methyl]benzamide
CID 120948973
4-(morpholin-4-ylmethyl)-N-[6-[[4-(morpholin-4-ylmethyl)benzoyl]amino]hexyl]benzamide
CID 2864244
N-[[4-(benzimidazol-1-yl)phenyl]methyl]-1-azabicyclo[3.2.1]octane-5-carboxamide
CID 166402905

Frequently Asked Questions

What is the IUPAC name of 4-(benzimidazol-1-yl)-N-[[4-(morpholin-4-ylmethyl)phenyl]methyl]benzamide?
The IUPAC name of 4-(benzimidazol-1-yl)-N-[[4-(morpholin-4-ylmethyl)phenyl]methyl]benzamide (CID 24549547) is 4-(benzimidazol-1-yl)-N-[[4-(morpholin-4-ylmethyl)phenyl]methyl]benzamide.
What is the SMILES notation for 4-(benzimidazol-1-yl)-N-[[4-(morpholin-4-ylmethyl)phenyl]methyl]benzamide?
The canonical SMILES for 4-(benzimidazol-1-yl)-N-[[4-(morpholin-4-ylmethyl)phenyl]methyl]benzamide is O=C(NCc1ccc(CN2CCOCC2)cc1)c1ccc(-n2cnc3ccccc32)cc1.
What is the InChIKey of 4-(benzimidazol-1-yl)-N-[[4-(morpholin-4-ylmethyl)phenyl]methyl]benzamide?
The InChIKey is HFQFHJBQYSXEOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H26N4O2/c31-26(27-17-20-5-7-21(8-6-20)18-29-13-15-32-16-14-29)22-9-11-23(12-10-22)30-19-28-24-3-1-2-4-25(24)30/h1-12,19H,13-18H2,(H,27,31).
What are the key properties of 4-(benzimidazol-1-yl)-N-[[4-(morpholin-4-ylmethyl)phenyl]methyl]benzamide?
4-(benzimidazol-1-yl)-N-[[4-(morpholin-4-ylmethyl)phenyl]methyl]benzamide has a molecular weight of 426.52 g/mol, XLogP of 3.79, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(benzimidazol-1-yl)-N-[[4-(morpholin-4-ylmethyl)phenyl]methyl]benzamide is sourced from PubChem (CID 24549547), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).