N-[2-(1H-benzimidazol-2-yl)phenyl]-3-ethoxy-4-methoxybenzamide

C23H21N3O3 — CID 134059402

IUPACN-[2-(1H-benzimidazol-2-yl)phenyl]-3-ethoxy-4-methoxybenzamide
SMILESCCOc1cc(C(=O)Nc2ccccc2-c2nc3ccccc3[nH]2)ccc1OC
InChIInChI=1S/C23H21N3O3/c1-3-29-21-14-15(12-13-20(21)28-2)23(27)26-17-9-5-4-8-16(17)22-24-18-10-6-7-11-19(18)25-22/h4-14H,3H2,1-2H3,(H,24,25)(H,26,27)
InChIKeyOZIHARNRYHSDIH-UHFFFAOYSA-N
MW387.44 g/mol
LogP4.89
Rot. Bonds6

About N-[2-(1H-benzimidazol-2-yl)phenyl]-3-ethoxy-4-methoxybenzamide

N-[2-(1H-benzimidazol-2-yl)phenyl]-3-ethoxy-4-methoxybenzamide (PubChem CID 134059402) has the molecular formula C23H21N3O3 and a molecular weight of 387.44 g/mol. Its IUPAC name is N-[2-(1H-benzimidazol-2-yl)phenyl]-3-ethoxy-4-methoxybenzamide.

Molecular Properties

Compound NameN-[2-(1H-benzimidazol-2-yl)phenyl]-3-ethoxy-4-methoxybenzamide
PubChem CID134059402
Molecular FormulaC23H21N3O3
Molecular Weight387.44 g/mol
Exact Mass387.16
IUPAC NameN-[2-(1H-benzimidazol-2-yl)phenyl]-3-ethoxy-4-methoxybenzamide
SMILESCCOc1cc(C(=O)Nc2ccccc2-c2nc3ccccc3[nH]2)ccc1OC
InChIInChI=1S/C23H21N3O3/c1-3-29-21-14-15(12-13-20(21)28-2)23(27)26-17-9-5-4-8-16(17)22-24-18-10-6-7-11-19(18)25-22/h4-14H,3H2,1-2H3,(H,24,25)(H,26,27)
InChIKeyOZIHARNRYHSDIH-UHFFFAOYSA-N
XLogP4.89
TPSA76.24 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500387.44
LogP ≤ 54.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-[2-(1H-benzimidazol-2-yl)phenyl]-3-ethoxy-4-methoxybenzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[2-(1H-benzimidazol-2-yl)phenyl]-3-methoxy-4-(pyrrolidin-1-ylmethyl)benzamide
CID 59679963
N-[2-(1H-benzimidazol-2-yl)phenyl]-3-methoxybenzamide
CID 742047
N-[5-(1H-benzimidazol-2-yl)-2-methoxyphenyl]-4-ethoxy-3-nitrobenzamide
CID 17093048
N-[3-(1H-benzimidazol-2-yl)-4-chlorophenyl]-3-chloro-4-ethoxybenzamide
CID 1352608
N-[7-(1H-benzimidazol-2-yl)-3H-azepin-2-yl]-3,4-dimethoxybenzamide
CID 143409158
N-[2-(1H-benzimidazol-2-yl)phenyl]-4-(ethylsulfanylmethyl)benzamide
CID 60527286
3,4-diethoxy-N-(2-methoxyphenyl)benzamide
CID 669527
3-(1H-benzimidazol-2-yl)-4-methoxybenzoic acid
CID 168554913
N-[2-(1H-benzimidazol-2-yl)phenyl]-3-(diethylsulfamoyl)benzamide
CID 167924073
N-[1-(1H-benzimidazol-2-yl)-2-methylbutyl]-3-ethoxy-4-methoxybenzamide
CID 55814527
N-[2-(1H-benzimidazol-2-yl)phenyl]acetamide
CID 5137262
N-[2-(1H-benzimidazol-2-yl)phenyl]-3-(difluoromethoxy)benzamide
CID 5159784

Frequently Asked Questions

What is the IUPAC name of N-[2-(1H-benzimidazol-2-yl)phenyl]-3-ethoxy-4-methoxybenzamide?
The IUPAC name of N-[2-(1H-benzimidazol-2-yl)phenyl]-3-ethoxy-4-methoxybenzamide (CID 134059402) is N-[2-(1H-benzimidazol-2-yl)phenyl]-3-ethoxy-4-methoxybenzamide.
What is the SMILES notation for N-[2-(1H-benzimidazol-2-yl)phenyl]-3-ethoxy-4-methoxybenzamide?
The canonical SMILES for N-[2-(1H-benzimidazol-2-yl)phenyl]-3-ethoxy-4-methoxybenzamide is CCOc1cc(C(=O)Nc2ccccc2-c2nc3ccccc3[nH]2)ccc1OC.
What is the InChIKey of N-[2-(1H-benzimidazol-2-yl)phenyl]-3-ethoxy-4-methoxybenzamide?
The InChIKey is OZIHARNRYHSDIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H21N3O3/c1-3-29-21-14-15(12-13-20(21)28-2)23(27)26-17-9-5-4-8-16(17)22-24-18-10-6-7-11-19(18)25-22/h4-14H,3H2,1-2H3,(H,24,25)(H,26,27).
What are the key properties of N-[2-(1H-benzimidazol-2-yl)phenyl]-3-ethoxy-4-methoxybenzamide?
N-[2-(1H-benzimidazol-2-yl)phenyl]-3-ethoxy-4-methoxybenzamide has a molecular weight of 387.44 g/mol, XLogP of 4.89, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(1H-benzimidazol-2-yl)phenyl]-3-ethoxy-4-methoxybenzamide is sourced from PubChem (CID 134059402), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).