N-[2-(2-cyclopropyl-1-methylbenzimidazol-5-yl)ethyl]-2-methoxybenzamide

C21H23N3O2 — CID 110791879

IUPACN-[2-(2-cyclopropyl-1-methylbenzimidazol-5-yl)ethyl]-2-methoxybenzamide
SMILESCOc1ccccc1C(=O)NCCc1ccc2c(c1)nc(C1CC1)n2C
InChIInChI=1S/C21H23N3O2/c1-24-18-10-7-14(13-17(18)23-20(24)15-8-9-15)11-12-22-21(25)16-5-3-4-6-19(16)26-2/h3-7,10,13,15H,8-9,11-12H2,1-2H3,(H,22,25)
InChIKeyHVZZRDMTFYRBGV-UHFFFAOYSA-N
MW349.43 g/mol
LogP3.43
Rot. Bonds6

About N-[2-(2-cyclopropyl-1-methylbenzimidazol-5-yl)ethyl]-2-methoxybenzamide

N-[2-(2-cyclopropyl-1-methylbenzimidazol-5-yl)ethyl]-2-methoxybenzamide (PubChem CID 110791879) has the molecular formula C21H23N3O2 and a molecular weight of 349.43 g/mol. Its IUPAC name is N-[2-(2-cyclopropyl-1-methylbenzimidazol-5-yl)ethyl]-2-methoxybenzamide.

Molecular Properties

Compound NameN-[2-(2-cyclopropyl-1-methylbenzimidazol-5-yl)ethyl]-2-methoxybenzamide
PubChem CID110791879
Molecular FormulaC21H23N3O2
Molecular Weight349.43 g/mol
Exact Mass349.18
IUPAC NameN-[2-(2-cyclopropyl-1-methylbenzimidazol-5-yl)ethyl]-2-methoxybenzamide
SMILESCOc1ccccc1C(=O)NCCc1ccc2c(c1)nc(C1CC1)n2C
InChIInChI=1S/C21H23N3O2/c1-24-18-10-7-14(13-17(18)23-20(24)15-8-9-15)11-12-22-21(25)16-5-3-4-6-19(16)26-2/h3-7,10,13,15H,8-9,11-12H2,1-2H3,(H,22,25)
InChIKeyHVZZRDMTFYRBGV-UHFFFAOYSA-N
XLogP3.43
TPSA56.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.43
LogP ≤ 53.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(2-cyclopropyl-1-methylbenzimidazol-5-yl)methyl]-2-methoxybenzamide
CID 110786150
N-[2-(2-cyclopropyl-1-methylbenzimidazol-5-yl)ethyl]propanamide
CID 110791866
1-benzyl-3-[2-(2-cyclopropyl-1-methylbenzimidazol-5-yl)ethyl]urea
CID 110776249
2-(2-cyclopropyl-1-methylbenzimidazol-5-yl)-N-[(4-methoxyphenyl)methyl]acetamide
CID 110773369
4-(2-cyclopropyl-1-methylbenzimidazol-5-yl)butan-2-one
CID 82497246
N-[2-[5-(2,2-dimethylpropanoylamino)-1-methylbenzimidazol-2-yl]ethyl]-2-methoxybenzamide
CID 46270417
3-cyclopropyl-N-[2-(3,4-dimethoxyphenyl)ethyl]imidazo[1,5-a]pyridine-1-carboxamide
CID 110412652
3-(2-cyclopropyl-1-methylbenzimidazol-5-yl)-N-methylpropan-1-amine
CID 96674760
2-(2-cyclopropyl-1-methylbenzimidazol-5-yl)-N-(2-methylpropyl)acetamide
CID 110773345
2-methoxy-N-[1-methyl-2-[2-(propanoylamino)ethyl]benzimidazol-5-yl]benzamide
CID 4895369
2-[4-[2-[(2-methoxybenzoyl)amino]ethyl]phenyl]acetic acid
CID 23453032
N-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethyl]-2-methoxybenzamide
CID 110787875

Frequently Asked Questions

What is the IUPAC name of N-[2-(2-cyclopropyl-1-methylbenzimidazol-5-yl)ethyl]-2-methoxybenzamide?
The IUPAC name of N-[2-(2-cyclopropyl-1-methylbenzimidazol-5-yl)ethyl]-2-methoxybenzamide (CID 110791879) is N-[2-(2-cyclopropyl-1-methylbenzimidazol-5-yl)ethyl]-2-methoxybenzamide.
What is the SMILES notation for N-[2-(2-cyclopropyl-1-methylbenzimidazol-5-yl)ethyl]-2-methoxybenzamide?
The canonical SMILES for N-[2-(2-cyclopropyl-1-methylbenzimidazol-5-yl)ethyl]-2-methoxybenzamide is COc1ccccc1C(=O)NCCc1ccc2c(c1)nc(C1CC1)n2C.
What is the InChIKey of N-[2-(2-cyclopropyl-1-methylbenzimidazol-5-yl)ethyl]-2-methoxybenzamide?
The InChIKey is HVZZRDMTFYRBGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H23N3O2/c1-24-18-10-7-14(13-17(18)23-20(24)15-8-9-15)11-12-22-21(25)16-5-3-4-6-19(16)26-2/h3-7,10,13,15H,8-9,11-12H2,1-2H3,(H,22,25).
What are the key properties of N-[2-(2-cyclopropyl-1-methylbenzimidazol-5-yl)ethyl]-2-methoxybenzamide?
N-[2-(2-cyclopropyl-1-methylbenzimidazol-5-yl)ethyl]-2-methoxybenzamide has a molecular weight of 349.43 g/mol, XLogP of 3.43, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-cyclopropyl-1-methylbenzimidazol-5-yl)ethyl]-2-methoxybenzamide is sourced from PubChem (CID 110791879), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).