2-(1,5-diethylbenzimidazol-2-yl)ethanamine

C13H19N3 — CID 82333476

IUPAC2-(1,5-diethylbenzimidazol-2-yl)ethanamine
SMILESCCc1ccc2c(c1)nc(CCN)n2CC
InChIInChI=1S/C13H19N3/c1-3-10-5-6-12-11(9-10)15-13(7-8-14)16(12)4-2/h5-6,9H,3-4,7-8,14H2,1-2H3
InChIKeyQLKGAYIZBSQGIM-UHFFFAOYSA-N
MW217.32 g/mol
LogP2.12
Rot. Bonds4

About 2-(1,5-diethylbenzimidazol-2-yl)ethanamine

2-(1,5-diethylbenzimidazol-2-yl)ethanamine (PubChem CID 82333476) has the molecular formula C13H19N3 and a molecular weight of 217.32 g/mol. Its IUPAC name is 2-(1,5-diethylbenzimidazol-2-yl)ethanamine.

Molecular Properties

Compound Name2-(1,5-diethylbenzimidazol-2-yl)ethanamine
PubChem CID82333476
Molecular FormulaC13H19N3
Molecular Weight217.32 g/mol
Exact Mass217.16
IUPAC Name2-(1,5-diethylbenzimidazol-2-yl)ethanamine
SMILESCCc1ccc2c(c1)nc(CCN)n2CC
InChIInChI=1S/C13H19N3/c1-3-10-5-6-12-11(9-10)15-13(7-8-14)16(12)4-2/h5-6,9H,3-4,7-8,14H2,1-2H3
InChIKeyQLKGAYIZBSQGIM-UHFFFAOYSA-N
XLogP2.12
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.32
LogP ≤ 52.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[5-ethyl-1-[(2-fluorophenyl)methyl]benzimidazol-2-yl]ethanamine
CID 82333467
2-(5-ethyl-1-propan-2-ylbenzimidazol-2-yl)ethanamine
CID 82333475
2-(1,5-diethylbenzimidazol-2-yl)acetonitrile
CID 82333726
[5-ethyl-1-[(2-fluorophenyl)methyl]benzimidazol-2-yl]methanamine
CID 82333492
2-[5-ethyl-1-(1-phenylethyl)benzimidazol-2-yl]ethanamine
CID 82333474
[2-(2-cyclopentylethyl)-1-ethylbenzimidazol-5-yl]methanamine
CID 65038299
3-[2-[(dimethylamino)methyl]-5-ethylbenzimidazol-1-yl]propan-1-amine
CID 82310788
N-[2-[5-(aminomethyl)-1-ethylbenzimidazol-2-yl]ethyl]-N-methylcyclobutanamine
CID 70865779
(5-ethyl-1-heptylbenzimidazol-2-yl)methanamine
CID 82333503
N-[2-(5-ethyl-1-propylbenzimidazol-2-yl)ethyl]propan-1-amine
CID 82333668
(5-ethyl-1-propan-2-ylbenzimidazol-2-yl)methanamine
CID 82333500
N-[2-[5-ethyl-1-(2-methylpropyl)benzimidazol-2-yl]ethyl]propan-2-amine
CID 82333691

Frequently Asked Questions

What is the IUPAC name of 2-(1,5-diethylbenzimidazol-2-yl)ethanamine?
The IUPAC name of 2-(1,5-diethylbenzimidazol-2-yl)ethanamine (CID 82333476) is 2-(1,5-diethylbenzimidazol-2-yl)ethanamine.
What is the SMILES notation for 2-(1,5-diethylbenzimidazol-2-yl)ethanamine?
The canonical SMILES for 2-(1,5-diethylbenzimidazol-2-yl)ethanamine is CCc1ccc2c(c1)nc(CCN)n2CC.
What is the InChIKey of 2-(1,5-diethylbenzimidazol-2-yl)ethanamine?
The InChIKey is QLKGAYIZBSQGIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N3/c1-3-10-5-6-12-11(9-10)15-13(7-8-14)16(12)4-2/h5-6,9H,3-4,7-8,14H2,1-2H3.
What are the key properties of 2-(1,5-diethylbenzimidazol-2-yl)ethanamine?
2-(1,5-diethylbenzimidazol-2-yl)ethanamine has a molecular weight of 217.32 g/mol, XLogP of 2.12, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1,5-diethylbenzimidazol-2-yl)ethanamine is sourced from PubChem (CID 82333476), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).