2-methoxy-N-(1-methyl-2-pyridin-3-yl-2,3-dihydrobenzimidazol-5-yl)benzamide

C21H20N4O2 — CID 170320460

IUPAC2-methoxy-N-(1-methyl-2-pyridin-3-yl-2,3-dihydrobenzimidazol-5-yl)benzamide
SMILESCOc1ccccc1C(=O)Nc1ccc2c(c1)NC(c1cccnc1)N2C
InChIInChI=1S/C21H20N4O2/c1-25-18-10-9-15(23-21(26)16-7-3-4-8-19(16)27-2)12-17(18)24-20(25)14-6-5-11-22-13-14/h3-13,20,24H,1-2H3,(H,23,26)
InChIKeyAORREKLCOXVCRV-UHFFFAOYSA-N
MW360.42 g/mol
LogP3.90
Rot. Bonds4

About 2-methoxy-N-(1-methyl-2-pyridin-3-yl-2,3-dihydrobenzimidazol-5-yl)benzamide

2-methoxy-N-(1-methyl-2-pyridin-3-yl-2,3-dihydrobenzimidazol-5-yl)benzamide (PubChem CID 170320460) has the molecular formula C21H20N4O2 and a molecular weight of 360.42 g/mol. Its IUPAC name is 2-methoxy-N-(1-methyl-2-pyridin-3-yl-2,3-dihydrobenzimidazol-5-yl)benzamide.

Molecular Properties

Compound Name2-methoxy-N-(1-methyl-2-pyridin-3-yl-2,3-dihydrobenzimidazol-5-yl)benzamide
PubChem CID170320460
Molecular FormulaC21H20N4O2
Molecular Weight360.42 g/mol
Exact Mass360.16
IUPAC Name2-methoxy-N-(1-methyl-2-pyridin-3-yl-2,3-dihydrobenzimidazol-5-yl)benzamide
SMILESCOc1ccccc1C(=O)Nc1ccc2c(c1)NC(c1cccnc1)N2C
InChIInChI=1S/C21H20N4O2/c1-25-18-10-9-15(23-21(26)16-7-3-4-8-19(16)27-2)12-17(18)24-20(25)14-6-5-11-22-13-14/h3-13,20,24H,1-2H3,(H,23,26)
InChIKeyAORREKLCOXVCRV-UHFFFAOYSA-N
XLogP3.90
TPSA66.49 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.42
LogP ≤ 53.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-methoxy-N-(1-methyl-2-pyridin-3-ylbenzimidazol-5-yl)benzamide
CID 169245109
2-methoxy-N-(3-methyl-2-pyridin-3-ylbenzimidazol-5-yl)benzamide
CID 169245110
2-methoxy-N-[4-[(2S)-2-pyridin-3-ylpiperidin-1-yl]sulfonylphenyl]benzamide
CID 40607024
2-methoxy-N-[4-(pyridin-3-ylsulfamoyl)phenyl]benzamide
CID 92646313
N-[(4S)-4-cyclopropyl-2-oxo-3,4-dihydro-1H-quinolin-7-yl]-2-methoxybenzamide
CID 95125652
2-methoxy-N-[3-(1-methylpiperidin-4-yl)-1H-indol-5-yl]benzamide
CID 22611451
2-methoxy-N-(3-methyl-2-pyridin-3-ylimidazo[4,5-b]pyridin-6-yl)benzamide
CID 169245066
N-[3-(2-imidazol-1-ylethoxy)phenyl]-2-methoxybenzamide
CID 47045466
N-[3-amino-4-[(2S)-2-methylpiperidin-1-yl]phenyl]-2-methoxybenzamide
CID 100803336
2-methoxy-N-[4-[4-[(2-methoxybenzoyl)amino]phenyl]phenyl]benzamide
CID 3299583
5-fluoro-2-methoxy-N-pyridin-3-ylbenzamide
CID 34947016
2-methoxy-N-[4-(2-methylimidazol-1-yl)-3-(trifluoromethyl)phenyl]benzamide
CID 141110853

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N-(1-methyl-2-pyridin-3-yl-2,3-dihydrobenzimidazol-5-yl)benzamide?
The IUPAC name of 2-methoxy-N-(1-methyl-2-pyridin-3-yl-2,3-dihydrobenzimidazol-5-yl)benzamide (CID 170320460) is 2-methoxy-N-(1-methyl-2-pyridin-3-yl-2,3-dihydrobenzimidazol-5-yl)benzamide.
What is the SMILES notation for 2-methoxy-N-(1-methyl-2-pyridin-3-yl-2,3-dihydrobenzimidazol-5-yl)benzamide?
The canonical SMILES for 2-methoxy-N-(1-methyl-2-pyridin-3-yl-2,3-dihydrobenzimidazol-5-yl)benzamide is COc1ccccc1C(=O)Nc1ccc2c(c1)NC(c1cccnc1)N2C.
What is the InChIKey of 2-methoxy-N-(1-methyl-2-pyridin-3-yl-2,3-dihydrobenzimidazol-5-yl)benzamide?
The InChIKey is AORREKLCOXVCRV-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H20N4O2/c1-25-18-10-9-15(23-21(26)16-7-3-4-8-19(16)27-2)12-17(18)24-20(25)14-6-5-11-22-13-14/h3-13,20,24H,1-2H3,(H,23,26).
What are the key properties of 2-methoxy-N-(1-methyl-2-pyridin-3-yl-2,3-dihydrobenzimidazol-5-yl)benzamide?
2-methoxy-N-(1-methyl-2-pyridin-3-yl-2,3-dihydrobenzimidazol-5-yl)benzamide has a molecular weight of 360.42 g/mol, XLogP of 3.90, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-(1-methyl-2-pyridin-3-yl-2,3-dihydrobenzimidazol-5-yl)benzamide is sourced from PubChem (CID 170320460), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).