1-(2-methoxyphenyl)benzimidazol-2-amine

C14H13N3O — CID 43148827

IUPAC1-(2-methoxyphenyl)benzimidazol-2-amine
SMILESCOc1ccccc1-n1c(N)nc2ccccc21
InChIInChI=1S/C14H13N3O/c1-18-13-9-5-4-8-12(13)17-11-7-3-2-6-10(11)16-14(17)15/h2-9H,1H3,(H2,15,16)
InChIKeyMERCHBBBCBRXPP-UHFFFAOYSA-N
MW239.28 g/mol
LogP2.62
Rot. Bonds2

About 1-(2-methoxyphenyl)benzimidazol-2-amine

1-(2-methoxyphenyl)benzimidazol-2-amine (PubChem CID 43148827) has the molecular formula C14H13N3O and a molecular weight of 239.28 g/mol. Its IUPAC name is 1-(2-methoxyphenyl)benzimidazol-2-amine.

Molecular Properties

Compound Name1-(2-methoxyphenyl)benzimidazol-2-amine
PubChem CID43148827
Molecular FormulaC14H13N3O
Molecular Weight239.28 g/mol
Exact Mass239.11
IUPAC Name1-(2-methoxyphenyl)benzimidazol-2-amine
SMILESCOc1ccccc1-n1c(N)nc2ccccc21
InChIInChI=1S/C14H13N3O/c1-18-13-9-5-4-8-12(13)17-11-7-3-2-6-10(11)16-14(17)15/h2-9H,1H3,(H2,15,16)
InChIKeyMERCHBBBCBRXPP-UHFFFAOYSA-N
XLogP2.62
TPSA53.07 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.28
LogP ≤ 52.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-(2-methoxyphenyl)benzimidazol-2-amine?
The IUPAC name of 1-(2-methoxyphenyl)benzimidazol-2-amine (CID 43148827) is 1-(2-methoxyphenyl)benzimidazol-2-amine.
What is the SMILES notation for 1-(2-methoxyphenyl)benzimidazol-2-amine?
The canonical SMILES for 1-(2-methoxyphenyl)benzimidazol-2-amine is COc1ccccc1-n1c(N)nc2ccccc21.
What is the InChIKey of 1-(2-methoxyphenyl)benzimidazol-2-amine?
The InChIKey is MERCHBBBCBRXPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13N3O/c1-18-13-9-5-4-8-12(13)17-11-7-3-2-6-10(11)16-14(17)15/h2-9H,1H3,(H2,15,16).
What are the key properties of 1-(2-methoxyphenyl)benzimidazol-2-amine?
1-(2-methoxyphenyl)benzimidazol-2-amine has a molecular weight of 239.28 g/mol, XLogP of 2.62, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methoxyphenyl)benzimidazol-2-amine is sourced from PubChem (CID 43148827), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).