N-cyclopropyl-2-(3-ethyl-2-oxobenzimidazol-1-yl)acetamide

C14H17N3O2 — CID 17445359

IUPACN-cyclopropyl-2-(3-ethyl-2-oxobenzimidazol-1-yl)acetamide
SMILESCCn1c(=O)n(CC(=O)NC2CC2)c2ccccc21
InChIInChI=1S/C14H17N3O2/c1-2-16-11-5-3-4-6-12(11)17(14(16)19)9-13(18)15-10-7-8-10/h3-6,10H,2,7-9H2,1H3,(H,15,18)
InChIKeyNQEKNNWMWZCKSB-UHFFFAOYSA-N
MW259.31 g/mol
LogP1.10
Rot. Bonds4

About N-cyclopropyl-2-(3-ethyl-2-oxobenzimidazol-1-yl)acetamide

N-cyclopropyl-2-(3-ethyl-2-oxobenzimidazol-1-yl)acetamide (PubChem CID 17445359) has the molecular formula C14H17N3O2 and a molecular weight of 259.31 g/mol. Its IUPAC name is N-cyclopropyl-2-(3-ethyl-2-oxobenzimidazol-1-yl)acetamide.

Molecular Properties

Compound NameN-cyclopropyl-2-(3-ethyl-2-oxobenzimidazol-1-yl)acetamide
PubChem CID17445359
Molecular FormulaC14H17N3O2
Molecular Weight259.31 g/mol
Exact Mass259.13
IUPAC NameN-cyclopropyl-2-(3-ethyl-2-oxobenzimidazol-1-yl)acetamide
SMILESCCn1c(=O)n(CC(=O)NC2CC2)c2ccccc21
InChIInChI=1S/C14H17N3O2/c1-2-16-11-5-3-4-6-12(11)17(14(16)19)9-13(18)15-10-7-8-10/h3-6,10H,2,7-9H2,1H3,(H,15,18)
InChIKeyNQEKNNWMWZCKSB-UHFFFAOYSA-N
XLogP1.10
TPSA56.03 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.31
LogP ≤ 51.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(3-ethyl-2-oxobenzimidazol-1-yl)-N-(4-methylcyclohexyl)acetamide
CID 18121435
2-[4-[[2-(3-ethyl-2-oxobenzimidazol-1-yl)acetyl]amino]piperidin-1-yl]acetamide
CID 134047876
N-(1-benzylpiperidin-4-yl)-2-(3-ethyl-2-oxobenzimidazol-1-yl)acetamide
CID 34363205
N-cyclooctyl-2-(3-ethyl-2,4-dioxoquinazolin-1-yl)acetamide
CID 22110617
N-(1-benzylpyrrolidin-3-yl)-2-(3-ethyl-2-oxobenzimidazol-1-yl)acetamide
CID 18156454
2-(3-ethyl-2-oxobenzimidazol-1-yl)-N-[3-(trifluoromethyl)cyclohexyl]acetamide
CID 18169394
2-(3-ethyl-2-oxobenzimidazol-1-yl)-N-[1-(furan-2-carbonyl)piperidin-4-yl]acetamide
CID 16613683
N-[2-(aminomethyl)cyclohexyl]-2-(3-ethyl-2-oxobenzimidazol-1-yl)acetamide;hydrochloride
CID 119610899
2-(3-ethyl-2-oxobenzimidazol-1-yl)-N-(1,2,3,4-tetrahydronaphthalen-1-yl)acetamide
CID 24587471
N-(1-methylsulfonylpiperidin-4-yl)-2-(2-oxo-3-propylbenzimidazol-1-yl)acetamide
CID 39999738
N-methyl-2-[4-[[2-(2-oxo-3-propylbenzimidazol-1-yl)acetyl]amino]piperidin-1-yl]acetamide
CID 32528500
2-(2-oxo-3-propylbenzimidazol-1-yl)-N-(1-pyrimidin-2-ylpiperidin-4-yl)acetamide
CID 47035376

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-2-(3-ethyl-2-oxobenzimidazol-1-yl)acetamide?
The IUPAC name of N-cyclopropyl-2-(3-ethyl-2-oxobenzimidazol-1-yl)acetamide (CID 17445359) is N-cyclopropyl-2-(3-ethyl-2-oxobenzimidazol-1-yl)acetamide.
What is the SMILES notation for N-cyclopropyl-2-(3-ethyl-2-oxobenzimidazol-1-yl)acetamide?
The canonical SMILES for N-cyclopropyl-2-(3-ethyl-2-oxobenzimidazol-1-yl)acetamide is CCn1c(=O)n(CC(=O)NC2CC2)c2ccccc21.
What is the InChIKey of N-cyclopropyl-2-(3-ethyl-2-oxobenzimidazol-1-yl)acetamide?
The InChIKey is NQEKNNWMWZCKSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3O2/c1-2-16-11-5-3-4-6-12(11)17(14(16)19)9-13(18)15-10-7-8-10/h3-6,10H,2,7-9H2,1H3,(H,15,18).
What are the key properties of N-cyclopropyl-2-(3-ethyl-2-oxobenzimidazol-1-yl)acetamide?
N-cyclopropyl-2-(3-ethyl-2-oxobenzimidazol-1-yl)acetamide has a molecular weight of 259.31 g/mol, XLogP of 1.10, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-2-(3-ethyl-2-oxobenzimidazol-1-yl)acetamide is sourced from PubChem (CID 17445359), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).