1-[2-(dimethylamino)ethyl]benzimidazol-2-amine

C11H16N4 — CID 745066

IUPAC1-[2-(dimethylamino)ethyl]benzimidazol-2-amine
SMILESCN(C)CCn1c(N)nc2ccccc21
InChIInChI=1S/C11H16N4/c1-14(2)7-8-15-10-6-4-3-5-9(10)13-11(15)12/h3-6H,7-8H2,1-2H3,(H2,12,13)
InChIKeyZILUPJDRTVRYTK-UHFFFAOYSA-N
MW204.28 g/mol
LogP1.18
Rot. Bonds3

About 1-[2-(dimethylamino)ethyl]benzimidazol-2-amine

1-[2-(dimethylamino)ethyl]benzimidazol-2-amine (PubChem CID 745066) has the molecular formula C11H16N4 and a molecular weight of 204.28 g/mol. Its IUPAC name is 1-[2-(dimethylamino)ethyl]benzimidazol-2-amine.

Molecular Properties

Compound Name1-[2-(dimethylamino)ethyl]benzimidazol-2-amine
PubChem CID745066
Molecular FormulaC11H16N4
Molecular Weight204.28 g/mol
Exact Mass204.14
IUPAC Name1-[2-(dimethylamino)ethyl]benzimidazol-2-amine
SMILESCN(C)CCn1c(N)nc2ccccc21
InChIInChI=1S/C11H16N4/c1-14(2)7-8-15-10-6-4-3-5-9(10)13-11(15)12/h3-6H,7-8H2,1-2H3,(H2,12,13)
InChIKeyZILUPJDRTVRYTK-UHFFFAOYSA-N
XLogP1.18
TPSA47.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.28
LogP ≤ 51.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-[2-(dimethylamino)ethyl]benzimidazol-2-amine?
The IUPAC name of 1-[2-(dimethylamino)ethyl]benzimidazol-2-amine (CID 745066) is 1-[2-(dimethylamino)ethyl]benzimidazol-2-amine.
What is the SMILES notation for 1-[2-(dimethylamino)ethyl]benzimidazol-2-amine?
The canonical SMILES for 1-[2-(dimethylamino)ethyl]benzimidazol-2-amine is CN(C)CCn1c(N)nc2ccccc21.
What is the InChIKey of 1-[2-(dimethylamino)ethyl]benzimidazol-2-amine?
The InChIKey is ZILUPJDRTVRYTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N4/c1-14(2)7-8-15-10-6-4-3-5-9(10)13-11(15)12/h3-6H,7-8H2,1-2H3,(H2,12,13).
What are the key properties of 1-[2-(dimethylamino)ethyl]benzimidazol-2-amine?
1-[2-(dimethylamino)ethyl]benzimidazol-2-amine has a molecular weight of 204.28 g/mol, XLogP of 1.18, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(dimethylamino)ethyl]benzimidazol-2-amine is sourced from PubChem (CID 745066), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).