4-ethyl-N-[2-(1-methylbenzimidazol-2-yl)ethyl]morpholine-2-carboxamide

C17H24N4O2 — CID 71984927

IUPAC4-ethyl-N-[2-(1-methylbenzimidazol-2-yl)ethyl]morpholine-2-carboxamide
SMILESCCN1CCOC(C(=O)NCCc2nc3ccccc3n2C)C1
InChIInChI=1S/C17H24N4O2/c1-3-21-10-11-23-15(12-21)17(22)18-9-8-16-19-13-6-4-5-7-14(13)20(16)2/h4-7,15H,3,8-12H2,1-2H3,(H,18,22)
InChIKeyTZLOESWJFVUEKF-UHFFFAOYSA-N
MW316.40 g/mol
LogP0.95
Rot. Bonds5

About 4-ethyl-N-[2-(1-methylbenzimidazol-2-yl)ethyl]morpholine-2-carboxamide

4-ethyl-N-[2-(1-methylbenzimidazol-2-yl)ethyl]morpholine-2-carboxamide (PubChem CID 71984927) has the molecular formula C17H24N4O2 and a molecular weight of 316.40 g/mol. Its IUPAC name is 4-ethyl-N-[2-(1-methylbenzimidazol-2-yl)ethyl]morpholine-2-carboxamide.

Molecular Properties

Compound Name4-ethyl-N-[2-(1-methylbenzimidazol-2-yl)ethyl]morpholine-2-carboxamide
PubChem CID71984927
Molecular FormulaC17H24N4O2
Molecular Weight316.40 g/mol
Exact Mass316.19
IUPAC Name4-ethyl-N-[2-(1-methylbenzimidazol-2-yl)ethyl]morpholine-2-carboxamide
SMILESCCN1CCOC(C(=O)NCCc2nc3ccccc3n2C)C1
InChIInChI=1S/C17H24N4O2/c1-3-21-10-11-23-15(12-21)17(22)18-9-8-16-19-13-6-4-5-7-14(13)20(16)2/h4-7,15H,3,8-12H2,1-2H3,(H,18,22)
InChIKeyTZLOESWJFVUEKF-UHFFFAOYSA-N
XLogP0.95
TPSA59.39 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.40
LogP ≤ 50.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[3-(1-methylbenzimidazol-2-yl)propyl]oxolane-2-carboxamide
CID 16981769
N-[2-(1-hexadecylbenzimidazol-2-yl)ethyl]oxolane-2-carboxamide
CID 16975315
N-[2-(1-dodecylbenzimidazol-2-yl)ethyl]oxolane-2-carboxamide
CID 16975314
N-[2-(1-methylbenzimidazol-2-yl)ethyl]-1,3-thiazolidine-4-carboxamide
CID 110741853
N-[2-(1-methylbenzimidazol-2-yl)ethyl]-2-(oxan-4-yl)propanamide
CID 91918229
1-(4,6-dimethylpyrimidin-2-yl)-N-[2-(1-methylbenzimidazol-2-yl)ethyl]piperidine-4-carboxamide
CID 71710226
methyl 2-[2-[2-(oxolane-2-carbonylamino)ethyl]benzimidazol-1-yl]acetate
CID 16975447
4-[2-(dimethylamino)-2-oxoethyl]-N-[2-(1-methylbenzimidazol-2-yl)ethyl]piperazine-1-carboxamide
CID 119064849
N-[2-(1-propan-2-ylbenzimidazol-2-yl)ethyl]morpholine-2-carboxamide
CID 119888867
(3R)-1-(2-amino-2-oxoethyl)-N-[3-(1-methylbenzimidazol-2-yl)propyl]piperidine-3-carboxamide
CID 97148275
(3R)-1-(2-methoxyacetyl)-N-[2-(1-methylbenzimidazol-2-yl)ethyl]piperidine-3-carboxamide
CID 97116576
N-[(6-chloro-1H-benzimidazol-2-yl)methyl]-4-[3-(1-methylbenzimidazol-2-yl)propanoyl]morpholine-2-carboxamide
CID 110082542

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-N-[2-(1-methylbenzimidazol-2-yl)ethyl]morpholine-2-carboxamide?
The IUPAC name of 4-ethyl-N-[2-(1-methylbenzimidazol-2-yl)ethyl]morpholine-2-carboxamide (CID 71984927) is 4-ethyl-N-[2-(1-methylbenzimidazol-2-yl)ethyl]morpholine-2-carboxamide.
What is the SMILES notation for 4-ethyl-N-[2-(1-methylbenzimidazol-2-yl)ethyl]morpholine-2-carboxamide?
The canonical SMILES for 4-ethyl-N-[2-(1-methylbenzimidazol-2-yl)ethyl]morpholine-2-carboxamide is CCN1CCOC(C(=O)NCCc2nc3ccccc3n2C)C1.
What is the InChIKey of 4-ethyl-N-[2-(1-methylbenzimidazol-2-yl)ethyl]morpholine-2-carboxamide?
The InChIKey is TZLOESWJFVUEKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N4O2/c1-3-21-10-11-23-15(12-21)17(22)18-9-8-16-19-13-6-4-5-7-14(13)20(16)2/h4-7,15H,3,8-12H2,1-2H3,(H,18,22).
What are the key properties of 4-ethyl-N-[2-(1-methylbenzimidazol-2-yl)ethyl]morpholine-2-carboxamide?
4-ethyl-N-[2-(1-methylbenzimidazol-2-yl)ethyl]morpholine-2-carboxamide has a molecular weight of 316.40 g/mol, XLogP of 0.95, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-N-[2-(1-methylbenzimidazol-2-yl)ethyl]morpholine-2-carboxamide is sourced from PubChem (CID 71984927), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).