1-(2-aminoethyl)-5-methylbenzimidazol-2-amine

C10H14N4 — CID 84771588

IUPAC1-(2-aminoethyl)-5-methylbenzimidazol-2-amine
SMILESCc1ccc2c(c1)nc(N)n2CCN
InChIInChI=1S/C10H14N4/c1-7-2-3-9-8(6-7)13-10(12)14(9)5-4-11/h2-3,6H,4-5,11H2,1H3,(H2,12,13)
InChIKeyRDYAXRNCVNBKRQ-UHFFFAOYSA-N
MW190.25 g/mol
LogP0.89
Rot. Bonds2

About 1-(2-aminoethyl)-5-methylbenzimidazol-2-amine

1-(2-aminoethyl)-5-methylbenzimidazol-2-amine (PubChem CID 84771588) has the molecular formula C10H14N4 and a molecular weight of 190.25 g/mol. Its IUPAC name is 1-(2-aminoethyl)-5-methylbenzimidazol-2-amine.

Molecular Properties

Compound Name1-(2-aminoethyl)-5-methylbenzimidazol-2-amine
PubChem CID84771588
Molecular FormulaC10H14N4
Molecular Weight190.25 g/mol
Exact Mass190.12
IUPAC Name1-(2-aminoethyl)-5-methylbenzimidazol-2-amine
SMILESCc1ccc2c(c1)nc(N)n2CCN
InChIInChI=1S/C10H14N4/c1-7-2-3-9-8(6-7)13-10(12)14(9)5-4-11/h2-3,6H,4-5,11H2,1H3,(H2,12,13)
InChIKeyRDYAXRNCVNBKRQ-UHFFFAOYSA-N
XLogP0.89
TPSA69.86 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.25
LogP ≤ 50.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-(2-aminoethyl)-5-methylbenzimidazol-2-amine?
The IUPAC name of 1-(2-aminoethyl)-5-methylbenzimidazol-2-amine (CID 84771588) is 1-(2-aminoethyl)-5-methylbenzimidazol-2-amine.
What is the SMILES notation for 1-(2-aminoethyl)-5-methylbenzimidazol-2-amine?
The canonical SMILES for 1-(2-aminoethyl)-5-methylbenzimidazol-2-amine is Cc1ccc2c(c1)nc(N)n2CCN.
What is the InChIKey of 1-(2-aminoethyl)-5-methylbenzimidazol-2-amine?
The InChIKey is RDYAXRNCVNBKRQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N4/c1-7-2-3-9-8(6-7)13-10(12)14(9)5-4-11/h2-3,6H,4-5,11H2,1H3,(H2,12,13).
What are the key properties of 1-(2-aminoethyl)-5-methylbenzimidazol-2-amine?
1-(2-aminoethyl)-5-methylbenzimidazol-2-amine has a molecular weight of 190.25 g/mol, XLogP of 0.89, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-aminoethyl)-5-methylbenzimidazol-2-amine is sourced from PubChem (CID 84771588), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).