N-[[1-[2-(3-methylphenoxy)ethyl]benzimidazol-2-yl]methyl]benzamide

C24H23N3O2 — CID 6625506

IUPACN-[[1-[2-(3-methylphenoxy)ethyl]benzimidazol-2-yl]methyl]benzamide
SMILESCc1cccc(OCCn2c(CNC(=O)c3ccccc3)nc3ccccc32)c1
InChIInChI=1S/C24H23N3O2/c1-18-8-7-11-20(16-18)29-15-14-27-22-13-6-5-12-21(22)26-23(27)17-25-24(28)19-9-3-2-4-10-19/h2-13,16H,14-15,17H2,1H3,(H,25,28)
InChIKeyRNDNQJZSZJEVOO-UHFFFAOYSA-N
MW385.47 g/mol
LogP4.35
Rot. Bonds7

About N-[[1-[2-(3-methylphenoxy)ethyl]benzimidazol-2-yl]methyl]benzamide

N-[[1-[2-(3-methylphenoxy)ethyl]benzimidazol-2-yl]methyl]benzamide (PubChem CID 6625506) has the molecular formula C24H23N3O2 and a molecular weight of 385.47 g/mol. Its IUPAC name is N-[[1-[2-(3-methylphenoxy)ethyl]benzimidazol-2-yl]methyl]benzamide.

Molecular Properties

Compound NameN-[[1-[2-(3-methylphenoxy)ethyl]benzimidazol-2-yl]methyl]benzamide
PubChem CID6625506
Molecular FormulaC24H23N3O2
Molecular Weight385.47 g/mol
Exact Mass385.18
IUPAC NameN-[[1-[2-(3-methylphenoxy)ethyl]benzimidazol-2-yl]methyl]benzamide
SMILESCc1cccc(OCCn2c(CNC(=O)c3ccccc3)nc3ccccc32)c1
InChIInChI=1S/C24H23N3O2/c1-18-8-7-11-20(16-18)29-15-14-27-22-13-6-5-12-21(22)26-23(27)17-25-24(28)19-9-3-2-4-10-19/h2-13,16H,14-15,17H2,1H3,(H,25,28)
InChIKeyRNDNQJZSZJEVOO-UHFFFAOYSA-N
XLogP4.35
TPSA56.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500385.47
LogP ≤ 54.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[[1-[2-(3-methylphenoxy)ethyl]benzimidazol-2-yl]methyl]benzamide?
The IUPAC name of N-[[1-[2-(3-methylphenoxy)ethyl]benzimidazol-2-yl]methyl]benzamide (CID 6625506) is N-[[1-[2-(3-methylphenoxy)ethyl]benzimidazol-2-yl]methyl]benzamide.
What is the SMILES notation for N-[[1-[2-(3-methylphenoxy)ethyl]benzimidazol-2-yl]methyl]benzamide?
The canonical SMILES for N-[[1-[2-(3-methylphenoxy)ethyl]benzimidazol-2-yl]methyl]benzamide is Cc1cccc(OCCn2c(CNC(=O)c3ccccc3)nc3ccccc32)c1.
What is the InChIKey of N-[[1-[2-(3-methylphenoxy)ethyl]benzimidazol-2-yl]methyl]benzamide?
The InChIKey is RNDNQJZSZJEVOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H23N3O2/c1-18-8-7-11-20(16-18)29-15-14-27-22-13-6-5-12-21(22)26-23(27)17-25-24(28)19-9-3-2-4-10-19/h2-13,16H,14-15,17H2,1H3,(H,25,28).
What are the key properties of N-[[1-[2-(3-methylphenoxy)ethyl]benzimidazol-2-yl]methyl]benzamide?
N-[[1-[2-(3-methylphenoxy)ethyl]benzimidazol-2-yl]methyl]benzamide has a molecular weight of 385.47 g/mol, XLogP of 4.35, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[1-[2-(3-methylphenoxy)ethyl]benzimidazol-2-yl]methyl]benzamide is sourced from PubChem (CID 6625506), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).