1-ethyl-6-methoxybenzimidazol-2-amine

C10H13N3O — CID 18761807

IUPAC1-ethyl-6-methoxybenzimidazol-2-amine
SMILESCCn1c(N)nc2ccc(OC)cc21
InChIInChI=1S/C10H13N3O/c1-3-13-9-6-7(14-2)4-5-8(9)12-10(13)11/h4-6H,3H2,1-2H3,(H2,11,12)
InChIKeyALWWUEXQVJQNTK-UHFFFAOYSA-N
MW191.23 g/mol
LogP1.65
Rot. Bonds2

About 1-ethyl-6-methoxybenzimidazol-2-amine

1-ethyl-6-methoxybenzimidazol-2-amine (PubChem CID 18761807) has the molecular formula C10H13N3O and a molecular weight of 191.23 g/mol. Its IUPAC name is 1-ethyl-6-methoxybenzimidazol-2-amine.

Molecular Properties

Compound Name1-ethyl-6-methoxybenzimidazol-2-amine
PubChem CID18761807
Molecular FormulaC10H13N3O
Molecular Weight191.23 g/mol
Exact Mass191.11
IUPAC Name1-ethyl-6-methoxybenzimidazol-2-amine
SMILESCCn1c(N)nc2ccc(OC)cc21
InChIInChI=1S/C10H13N3O/c1-3-13-9-6-7(14-2)4-5-8(9)12-10(13)11/h4-6H,3H2,1-2H3,(H2,11,12)
InChIKeyALWWUEXQVJQNTK-UHFFFAOYSA-N
XLogP1.65
TPSA53.07 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.23
LogP ≤ 51.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-ethyl-6-methoxybenzimidazol-2-amine?
The IUPAC name of 1-ethyl-6-methoxybenzimidazol-2-amine (CID 18761807) is 1-ethyl-6-methoxybenzimidazol-2-amine.
What is the SMILES notation for 1-ethyl-6-methoxybenzimidazol-2-amine?
The canonical SMILES for 1-ethyl-6-methoxybenzimidazol-2-amine is CCn1c(N)nc2ccc(OC)cc21.
What is the InChIKey of 1-ethyl-6-methoxybenzimidazol-2-amine?
The InChIKey is ALWWUEXQVJQNTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N3O/c1-3-13-9-6-7(14-2)4-5-8(9)12-10(13)11/h4-6H,3H2,1-2H3,(H2,11,12).
What are the key properties of 1-ethyl-6-methoxybenzimidazol-2-amine?
1-ethyl-6-methoxybenzimidazol-2-amine has a molecular weight of 191.23 g/mol, XLogP of 1.65, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-6-methoxybenzimidazol-2-amine is sourced from PubChem (CID 18761807), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).