N-(2-amino-2-oxoethyl)-3-[(1-ethylbenzimidazol-2-yl)methoxy]benzamide

C19H20N4O3 — CID 167909677

IUPACN-(2-amino-2-oxoethyl)-3-[(1-ethylbenzimidazol-2-yl)methoxy]benzamide
SMILESCCn1c(COc2cccc(C(=O)NCC(N)=O)c2)nc2ccccc21
InChIInChI=1S/C19H20N4O3/c1-2-23-16-9-4-3-8-15(16)22-18(23)12-26-14-7-5-6-13(10-14)19(25)21-11-17(20)24/h3-10H,2,11-12H2,1H3,(H2,20,24)(H,21,25)
InChIKeyYVQHDZMAJIPGFK-UHFFFAOYSA-N
MW352.39 g/mol
LogP1.85
Rot. Bonds7

About N-(2-amino-2-oxoethyl)-3-[(1-ethylbenzimidazol-2-yl)methoxy]benzamide

N-(2-amino-2-oxoethyl)-3-[(1-ethylbenzimidazol-2-yl)methoxy]benzamide (PubChem CID 167909677) has the molecular formula C19H20N4O3 and a molecular weight of 352.39 g/mol. Its IUPAC name is N-(2-amino-2-oxoethyl)-3-[(1-ethylbenzimidazol-2-yl)methoxy]benzamide.

Molecular Properties

Compound NameN-(2-amino-2-oxoethyl)-3-[(1-ethylbenzimidazol-2-yl)methoxy]benzamide
PubChem CID167909677
Molecular FormulaC19H20N4O3
Molecular Weight352.39 g/mol
Exact Mass352.15
IUPAC NameN-(2-amino-2-oxoethyl)-3-[(1-ethylbenzimidazol-2-yl)methoxy]benzamide
SMILESCCn1c(COc2cccc(C(=O)NCC(N)=O)c2)nc2ccccc21
InChIInChI=1S/C19H20N4O3/c1-2-23-16-9-4-3-8-15(16)22-18(23)12-26-14-7-5-6-13(10-14)19(25)21-11-17(20)24/h3-10H,2,11-12H2,1H3,(H2,20,24)(H,21,25)
InChIKeyYVQHDZMAJIPGFK-UHFFFAOYSA-N
XLogP1.85
TPSA99.24 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.39
LogP ≤ 51.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[2-(1-ethylbenzimidazol-2-yl)ethyl]-3,4-dimethoxybenzamide
CID 3237594
3-methoxy-N-[(1-octylbenzimidazol-2-yl)methyl]benzamide
CID 17007901
N-[4-[2-(1-ethylbenzimidazol-2-yl)ethyl]phenyl]-3-methoxybenzamide
CID 50765558
N-butyl-2-[2-[(3-methylphenoxy)methyl]benzimidazol-1-yl]acetamide
CID 17031952
3-methoxy-N-[[1-(2-methylbutyl)benzimidazol-2-yl]methyl]benzamide
CID 17007896
N-[(1-ethylbenzimidazol-2-yl)methyl]-3,4,5-trimethoxybenzamide
CID 17008524
N-[(1-ethylbenzimidazol-2-yl)methyl]-3-(methylsulfonylmethyl)benzamide
CID 55408980
3-bromo-N-[5-(1-ethylbenzimidazol-2-yl)pentyl]benzamide
CID 16990563
N-[3-(2-methylbenzimidazol-1-yl)propyl]-3-propoxybenzamide
CID 55794237
3-methyl-N-[[1-[4-(3-methylphenoxy)butyl]benzimidazol-2-yl]methyl]benzamide
CID 17007362
N-[2-(1-ethylbenzimidazol-2-yl)ethyl]-4-methoxybenzamide
CID 16976665
N-[2-[1-(2-amino-2-oxoethyl)benzimidazol-2-yl]ethyl]-3-methylbenzamide
CID 17030842

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-2-oxoethyl)-3-[(1-ethylbenzimidazol-2-yl)methoxy]benzamide?
The IUPAC name of N-(2-amino-2-oxoethyl)-3-[(1-ethylbenzimidazol-2-yl)methoxy]benzamide (CID 167909677) is N-(2-amino-2-oxoethyl)-3-[(1-ethylbenzimidazol-2-yl)methoxy]benzamide.
What is the SMILES notation for N-(2-amino-2-oxoethyl)-3-[(1-ethylbenzimidazol-2-yl)methoxy]benzamide?
The canonical SMILES for N-(2-amino-2-oxoethyl)-3-[(1-ethylbenzimidazol-2-yl)methoxy]benzamide is CCn1c(COc2cccc(C(=O)NCC(N)=O)c2)nc2ccccc21.
What is the InChIKey of N-(2-amino-2-oxoethyl)-3-[(1-ethylbenzimidazol-2-yl)methoxy]benzamide?
The InChIKey is YVQHDZMAJIPGFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N4O3/c1-2-23-16-9-4-3-8-15(16)22-18(23)12-26-14-7-5-6-13(10-14)19(25)21-11-17(20)24/h3-10H,2,11-12H2,1H3,(H2,20,24)(H,21,25).
What are the key properties of N-(2-amino-2-oxoethyl)-3-[(1-ethylbenzimidazol-2-yl)methoxy]benzamide?
N-(2-amino-2-oxoethyl)-3-[(1-ethylbenzimidazol-2-yl)methoxy]benzamide has a molecular weight of 352.39 g/mol, XLogP of 1.85, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-2-oxoethyl)-3-[(1-ethylbenzimidazol-2-yl)methoxy]benzamide is sourced from PubChem (CID 167909677), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).