1-(2-aminoethyl)-2-[1-(diethylamino)ethyl]benzimidazol-5-ol

C15H24N4O — CID 82310659

IUPAC1-(2-aminoethyl)-2-[1-(diethylamino)ethyl]benzimidazol-5-ol
SMILESCCN(CC)C(C)c1nc2cc(O)ccc2n1CCN
InChIInChI=1S/C15H24N4O/c1-4-18(5-2)11(3)15-17-13-10-12(20)6-7-14(13)19(15)9-8-16/h6-7,10-11,20H,4-5,8-9,16H2,1-3H3
InChIKeyJGEJSZIVSUYWMK-UHFFFAOYSA-N
MW276.38 g/mol
LogP2.10
Rot. Bonds6

About 1-(2-aminoethyl)-2-[1-(diethylamino)ethyl]benzimidazol-5-ol

1-(2-aminoethyl)-2-[1-(diethylamino)ethyl]benzimidazol-5-ol (PubChem CID 82310659) has the molecular formula C15H24N4O and a molecular weight of 276.38 g/mol. Its IUPAC name is 1-(2-aminoethyl)-2-[1-(diethylamino)ethyl]benzimidazol-5-ol.

Molecular Properties

Compound Name1-(2-aminoethyl)-2-[1-(diethylamino)ethyl]benzimidazol-5-ol
PubChem CID82310659
Molecular FormulaC15H24N4O
Molecular Weight276.38 g/mol
Exact Mass276.20
IUPAC Name1-(2-aminoethyl)-2-[1-(diethylamino)ethyl]benzimidazol-5-ol
SMILESCCN(CC)C(C)c1nc2cc(O)ccc2n1CCN
InChIInChI=1S/C15H24N4O/c1-4-18(5-2)11(3)15-17-13-10-12(20)6-7-14(13)19(15)9-8-16/h6-7,10-11,20H,4-5,8-9,16H2,1-3H3
InChIKeyJGEJSZIVSUYWMK-UHFFFAOYSA-N
XLogP2.10
TPSA67.31 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 52.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

1-[1-(2-aminoethyl)benzimidazol-2-yl]-N,N-diethylethanamine
CID 82310709
3-[2-[1-(diethylamino)ethyl]-5-fluorobenzimidazol-1-yl]propan-1-amine
CID 82310804
3-[2-[1-(dimethylamino)ethyl]-5-hydroxybenzimidazol-1-yl]-2-methylpropanenitrile
CID 82311096
2-amino-1-propylbenzimidazol-5-ol
CID 84771922
4-[2-[1-(dimethylamino)ethyl]-5-fluorobenzimidazol-1-yl]butan-1-amine
CID 82310864
2-(5,6-dimethyl-2-propan-2-ylbenzimidazol-1-yl)ethanamine
CID 82145095
1-(2-aminoethyl)-N,5-dimethyl-N-propan-2-ylbenzimidazol-2-amine
CID 115144217
2-amino-1-(5-methyl-1-propylbenzimidazol-2-yl)ethanol
CID 66165447
2-propan-2-yl-1-propylbenzimidazol-5-amine
CID 43830820
2-[2-[1-(dimethylamino)ethyl]-5-ethoxybenzimidazol-1-yl]ethanol
CID 82311699
3-amino-1-(5-methyl-1-propylbenzimidazol-2-yl)propan-1-ol
CID 107835397
3-(5-bromo-1-propylbenzimidazol-2-yl)butan-1-amine
CID 80539744

Frequently Asked Questions

What is the IUPAC name of 1-(2-aminoethyl)-2-[1-(diethylamino)ethyl]benzimidazol-5-ol?
The IUPAC name of 1-(2-aminoethyl)-2-[1-(diethylamino)ethyl]benzimidazol-5-ol (CID 82310659) is 1-(2-aminoethyl)-2-[1-(diethylamino)ethyl]benzimidazol-5-ol.
What is the SMILES notation for 1-(2-aminoethyl)-2-[1-(diethylamino)ethyl]benzimidazol-5-ol?
The canonical SMILES for 1-(2-aminoethyl)-2-[1-(diethylamino)ethyl]benzimidazol-5-ol is CCN(CC)C(C)c1nc2cc(O)ccc2n1CCN.
What is the InChIKey of 1-(2-aminoethyl)-2-[1-(diethylamino)ethyl]benzimidazol-5-ol?
The InChIKey is JGEJSZIVSUYWMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4O/c1-4-18(5-2)11(3)15-17-13-10-12(20)6-7-14(13)19(15)9-8-16/h6-7,10-11,20H,4-5,8-9,16H2,1-3H3.
What are the key properties of 1-(2-aminoethyl)-2-[1-(diethylamino)ethyl]benzimidazol-5-ol?
1-(2-aminoethyl)-2-[1-(diethylamino)ethyl]benzimidazol-5-ol has a molecular weight of 276.38 g/mol, XLogP of 2.10, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-aminoethyl)-2-[1-(diethylamino)ethyl]benzimidazol-5-ol is sourced from PubChem (CID 82310659), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).