N-(2-methoxyethyl)-2-[1-(2-oxo-1,3-dihydrobenzimidazol-5-yl)ethylamino]acetamide

C14H20N4O3 — CID 115898285

IUPACN-(2-methoxyethyl)-2-[1-(2-oxo-1,3-dihydrobenzimidazol-5-yl)ethylamino]acetamide
SMILESCOCCNC(=O)CNC(C)c1ccc2[nH]c(=O)[nH]c2c1
InChIInChI=1S/C14H20N4O3/c1-9(16-8-13(19)15-5-6-21-2)10-3-4-11-12(7-10)18-14(20)17-11/h3-4,7,9,16H,5-6,8H2,1-2H3,(H,15,19)(H2,17,18,20)
InChIKeyPWRBFDRLNVQXNL-UHFFFAOYSA-N
MW292.34 g/mol
LogP0.27
Rot. Bonds7

About N-(2-methoxyethyl)-2-[1-(2-oxo-1,3-dihydrobenzimidazol-5-yl)ethylamino]acetamide

N-(2-methoxyethyl)-2-[1-(2-oxo-1,3-dihydrobenzimidazol-5-yl)ethylamino]acetamide (PubChem CID 115898285) has the molecular formula C14H20N4O3 and a molecular weight of 292.34 g/mol. Its IUPAC name is N-(2-methoxyethyl)-2-[1-(2-oxo-1,3-dihydrobenzimidazol-5-yl)ethylamino]acetamide.

Molecular Properties

Compound NameN-(2-methoxyethyl)-2-[1-(2-oxo-1,3-dihydrobenzimidazol-5-yl)ethylamino]acetamide
PubChem CID115898285
Molecular FormulaC14H20N4O3
Molecular Weight292.34 g/mol
Exact Mass292.15
IUPAC NameN-(2-methoxyethyl)-2-[1-(2-oxo-1,3-dihydrobenzimidazol-5-yl)ethylamino]acetamide
SMILESCOCCNC(=O)CNC(C)c1ccc2[nH]c(=O)[nH]c2c1
InChIInChI=1S/C14H20N4O3/c1-9(16-8-13(19)15-5-6-21-2)10-3-4-11-12(7-10)18-14(20)17-11/h3-4,7,9,16H,5-6,8H2,1-2H3,(H,15,19)(H2,17,18,20)
InChIKeyPWRBFDRLNVQXNL-UHFFFAOYSA-N
XLogP0.27
TPSA99.01 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.34
LogP ≤ 50.27
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-(2-methoxyethyl)-2-[[(1R)-1-(4-methoxyphenyl)ethyl]amino]acetamide
CID 81371226
2-[[(1R)-1-(4-fluorophenyl)ethyl]amino]-N-(3-methoxypropyl)acetamide
CID 81348232
2-[1-(4-bromophenyl)ethylamino]-N-(3-methoxypropyl)acetamide
CID 60641631
N-(3-methoxypropyl)-2-[[(1R)-1-(3-methylphenyl)ethyl]amino]acetamide
CID 81361482
N-(2-methoxyethyl)-2-[1-(2-methylphenyl)ethylamino]acetamide
CID 60641541
5-[(1S)-1-[(2-methoxyphenyl)methylamino]ethyl]-1,3-dihydrobenzimidazol-2-one
CID 95938822
N-(2-methoxyethyl)-2-[1-(2-methoxy-5-methylphenyl)ethylamino]acetamide
CID 115573579
5-[1-[(2-cyclopropyl-2-hydroxyethyl)amino]ethyl]-1,3-dihydrobenzimidazol-2-one
CID 55172165
2-[4-[1-(ethylamino)ethyl]phenoxy]-N-(2-methoxyethyl)acetamide
CID 61487528
N-(2-methoxyethyl)-3-[1-(4-methoxyphenyl)ethylamino]propanamide
CID 115712008
3-[1-(3-bromophenyl)ethylamino]-N-(2-methoxyethyl)propanamide
CID 115667940
5-[1-[2-[cyclopropyl(methyl)amino]ethylamino]ethyl]-1,3-dihydrobenzimidazol-2-one
CID 62977011

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyethyl)-2-[1-(2-oxo-1,3-dihydrobenzimidazol-5-yl)ethylamino]acetamide?
The IUPAC name of N-(2-methoxyethyl)-2-[1-(2-oxo-1,3-dihydrobenzimidazol-5-yl)ethylamino]acetamide (CID 115898285) is N-(2-methoxyethyl)-2-[1-(2-oxo-1,3-dihydrobenzimidazol-5-yl)ethylamino]acetamide.
What is the SMILES notation for N-(2-methoxyethyl)-2-[1-(2-oxo-1,3-dihydrobenzimidazol-5-yl)ethylamino]acetamide?
The canonical SMILES for N-(2-methoxyethyl)-2-[1-(2-oxo-1,3-dihydrobenzimidazol-5-yl)ethylamino]acetamide is COCCNC(=O)CNC(C)c1ccc2[nH]c(=O)[nH]c2c1.
What is the InChIKey of N-(2-methoxyethyl)-2-[1-(2-oxo-1,3-dihydrobenzimidazol-5-yl)ethylamino]acetamide?
The InChIKey is PWRBFDRLNVQXNL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N4O3/c1-9(16-8-13(19)15-5-6-21-2)10-3-4-11-12(7-10)18-14(20)17-11/h3-4,7,9,16H,5-6,8H2,1-2H3,(H,15,19)(H2,17,18,20).
What are the key properties of N-(2-methoxyethyl)-2-[1-(2-oxo-1,3-dihydrobenzimidazol-5-yl)ethylamino]acetamide?
N-(2-methoxyethyl)-2-[1-(2-oxo-1,3-dihydrobenzimidazol-5-yl)ethylamino]acetamide has a molecular weight of 292.34 g/mol, XLogP of 0.27, 7 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyethyl)-2-[1-(2-oxo-1,3-dihydrobenzimidazol-5-yl)ethylamino]acetamide is sourced from PubChem (CID 115898285), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).