5-(1-ethyl-4-fluorobenzimidazol-2-yl)pyridin-2-amine

C14H13FN4 — CID 63262168

IUPAC5-(1-ethyl-4-fluorobenzimidazol-2-yl)pyridin-2-amine
SMILESCCn1c(-c2ccc(N)nc2)nc2c(F)cccc21
InChIInChI=1S/C14H13FN4/c1-2-19-11-5-3-4-10(15)13(11)18-14(19)9-6-7-12(16)17-8-9/h3-8H,2H2,1H3,(H2,16,17)
InChIKeyRZCVDQNQNBLHFJ-UHFFFAOYSA-N
MW256.28 g/mol
LogP2.84
Rot. Bonds2

About 5-(1-ethyl-4-fluorobenzimidazol-2-yl)pyridin-2-amine

5-(1-ethyl-4-fluorobenzimidazol-2-yl)pyridin-2-amine (PubChem CID 63262168) has the molecular formula C14H13FN4 and a molecular weight of 256.28 g/mol. Its IUPAC name is 5-(1-ethyl-4-fluorobenzimidazol-2-yl)pyridin-2-amine.

Molecular Properties

Compound Name5-(1-ethyl-4-fluorobenzimidazol-2-yl)pyridin-2-amine
PubChem CID63262168
Molecular FormulaC14H13FN4
Molecular Weight256.28 g/mol
Exact Mass256.11
IUPAC Name5-(1-ethyl-4-fluorobenzimidazol-2-yl)pyridin-2-amine
SMILESCCn1c(-c2ccc(N)nc2)nc2c(F)cccc21
InChIInChI=1S/C14H13FN4/c1-2-19-11-5-3-4-10(15)13(11)18-14(19)9-6-7-12(16)17-8-9/h3-8H,2H2,1H3,(H2,16,17)
InChIKeyRZCVDQNQNBLHFJ-UHFFFAOYSA-N
XLogP2.84
TPSA56.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.28
LogP ≤ 52.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-(1-ethyl-4-fluorobenzimidazol-2-yl)pyridin-2-amine?
The IUPAC name of 5-(1-ethyl-4-fluorobenzimidazol-2-yl)pyridin-2-amine (CID 63262168) is 5-(1-ethyl-4-fluorobenzimidazol-2-yl)pyridin-2-amine.
What is the SMILES notation for 5-(1-ethyl-4-fluorobenzimidazol-2-yl)pyridin-2-amine?
The canonical SMILES for 5-(1-ethyl-4-fluorobenzimidazol-2-yl)pyridin-2-amine is CCn1c(-c2ccc(N)nc2)nc2c(F)cccc21.
What is the InChIKey of 5-(1-ethyl-4-fluorobenzimidazol-2-yl)pyridin-2-amine?
The InChIKey is RZCVDQNQNBLHFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13FN4/c1-2-19-11-5-3-4-10(15)13(11)18-14(19)9-6-7-12(16)17-8-9/h3-8H,2H2,1H3,(H2,16,17).
What are the key properties of 5-(1-ethyl-4-fluorobenzimidazol-2-yl)pyridin-2-amine?
5-(1-ethyl-4-fluorobenzimidazol-2-yl)pyridin-2-amine has a molecular weight of 256.28 g/mol, XLogP of 2.84, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(1-ethyl-4-fluorobenzimidazol-2-yl)pyridin-2-amine is sourced from PubChem (CID 63262168), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).