N-[(1-ethylbenzimidazol-2-yl)methyl]-2-methoxybenzamide

C18H19N3O2 — CID 17007568

IUPACN-[(1-ethylbenzimidazol-2-yl)methyl]-2-methoxybenzamide
SMILESCCn1c(CNC(=O)c2ccccc2OC)nc2ccccc21
InChIInChI=1S/C18H19N3O2/c1-3-21-15-10-6-5-9-14(15)20-17(21)12-19-18(22)13-8-4-7-11-16(13)23-2/h4-11H,3,12H2,1-2H3,(H,19,22)
InChIKeyZLWIDNSPXMIHPR-UHFFFAOYSA-N
MW309.37 g/mol
LogP2.99
Rot. Bonds5

About N-[(1-ethylbenzimidazol-2-yl)methyl]-2-methoxybenzamide

N-[(1-ethylbenzimidazol-2-yl)methyl]-2-methoxybenzamide (PubChem CID 17007568) has the molecular formula C18H19N3O2 and a molecular weight of 309.37 g/mol. Its IUPAC name is N-[(1-ethylbenzimidazol-2-yl)methyl]-2-methoxybenzamide.

Molecular Properties

Compound NameN-[(1-ethylbenzimidazol-2-yl)methyl]-2-methoxybenzamide
PubChem CID17007568
Molecular FormulaC18H19N3O2
Molecular Weight309.37 g/mol
Exact Mass309.15
IUPAC NameN-[(1-ethylbenzimidazol-2-yl)methyl]-2-methoxybenzamide
SMILESCCn1c(CNC(=O)c2ccccc2OC)nc2ccccc21
InChIInChI=1S/C18H19N3O2/c1-3-21-15-10-6-5-9-14(15)20-17(21)12-19-18(22)13-8-4-7-11-16(13)23-2/h4-11H,3,12H2,1-2H3,(H,19,22)
InChIKeyZLWIDNSPXMIHPR-UHFFFAOYSA-N
XLogP2.99
TPSA56.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.37
LogP ≤ 52.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-methoxy-N-[(1-propylbenzimidazol-2-yl)methyl]benzamide
CID 17007570
2-methoxy-N-[[1-[3-(2-propan-2-ylphenoxy)propyl]benzimidazol-2-yl]methyl]benzamide
CID 17007646
2-methoxy-N-[[1-(naphthalen-2-ylmethyl)benzimidazol-2-yl]methyl]benzamide
CID 17007607
N-[(1-ethylbenzimidazol-2-yl)methyl]-3,4,5-trimethoxybenzamide
CID 17008524
N-[[1-[(4-butan-2-ylphenyl)methyl]benzimidazol-2-yl]methyl]-2-methoxybenzamide
CID 17007602
2-methoxy-N-[[1-[4-(4-methylphenoxy)butyl]benzimidazol-2-yl]methyl]benzamide
CID 17007722
N-[[1-[4-(4-ethylphenoxy)butyl]benzimidazol-2-yl]methyl]-2-methoxybenzamide
CID 17007688
N-[(1-ethylbenzimidazol-2-yl)methyl]-2-(2,3,4-trimethoxyphenyl)acetamide
CID 18093027
N-[[1-[4-(3,5-dimethylphenoxy)butyl]benzimidazol-2-yl]methyl]-2-methoxybenzamide
CID 17007684
N-[(1-ethylbenzimidazol-2-yl)methyl]-2-(4-methoxyphenyl)acetamide
CID 17477086
methyl 2-[2-[2-[(2-methoxybenzoyl)amino]ethyl]benzimidazol-1-yl]acetate
CID 16976330
2-methoxy-N-[2-(1-octadecylbenzimidazol-2-yl)ethyl]benzamide
CID 16976201

Frequently Asked Questions

What is the IUPAC name of N-[(1-ethylbenzimidazol-2-yl)methyl]-2-methoxybenzamide?
The IUPAC name of N-[(1-ethylbenzimidazol-2-yl)methyl]-2-methoxybenzamide (CID 17007568) is N-[(1-ethylbenzimidazol-2-yl)methyl]-2-methoxybenzamide.
What is the SMILES notation for N-[(1-ethylbenzimidazol-2-yl)methyl]-2-methoxybenzamide?
The canonical SMILES for N-[(1-ethylbenzimidazol-2-yl)methyl]-2-methoxybenzamide is CCn1c(CNC(=O)c2ccccc2OC)nc2ccccc21.
What is the InChIKey of N-[(1-ethylbenzimidazol-2-yl)methyl]-2-methoxybenzamide?
The InChIKey is ZLWIDNSPXMIHPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19N3O2/c1-3-21-15-10-6-5-9-14(15)20-17(21)12-19-18(22)13-8-4-7-11-16(13)23-2/h4-11H,3,12H2,1-2H3,(H,19,22).
What are the key properties of N-[(1-ethylbenzimidazol-2-yl)methyl]-2-methoxybenzamide?
N-[(1-ethylbenzimidazol-2-yl)methyl]-2-methoxybenzamide has a molecular weight of 309.37 g/mol, XLogP of 2.99, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-ethylbenzimidazol-2-yl)methyl]-2-methoxybenzamide is sourced from PubChem (CID 17007568), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).