5-(1-cyclopropyl-6-fluorobenzimidazol-2-yl)thiophen-2-amine

C14H12FN3S — CID 62387448

IUPAC5-(1-cyclopropyl-6-fluorobenzimidazol-2-yl)thiophen-2-amine
SMILESNc1ccc(-c2nc3ccc(F)cc3n2C2CC2)s1
InChIInChI=1S/C14H12FN3S/c15-8-1-4-10-11(7-8)18(9-2-3-9)14(17-10)12-5-6-13(16)19-12/h1,4-7,9H,2-3,16H2
InChIKeyHPVZRNIDQNNUEI-UHFFFAOYSA-N
MW273.34 g/mol
LogP3.82
Rot. Bonds2

About 5-(1-cyclopropyl-6-fluorobenzimidazol-2-yl)thiophen-2-amine

5-(1-cyclopropyl-6-fluorobenzimidazol-2-yl)thiophen-2-amine (PubChem CID 62387448) has the molecular formula C14H12FN3S and a molecular weight of 273.34 g/mol. Its IUPAC name is 5-(1-cyclopropyl-6-fluorobenzimidazol-2-yl)thiophen-2-amine.

Molecular Properties

Compound Name5-(1-cyclopropyl-6-fluorobenzimidazol-2-yl)thiophen-2-amine
PubChem CID62387448
Molecular FormulaC14H12FN3S
Molecular Weight273.34 g/mol
Exact Mass273.07
IUPAC Name5-(1-cyclopropyl-6-fluorobenzimidazol-2-yl)thiophen-2-amine
SMILESNc1ccc(-c2nc3ccc(F)cc3n2C2CC2)s1
InChIInChI=1S/C14H12FN3S/c15-8-1-4-10-11(7-8)18(9-2-3-9)14(17-10)12-5-6-13(16)19-12/h1,4-7,9H,2-3,16H2
InChIKeyHPVZRNIDQNNUEI-UHFFFAOYSA-N
XLogP3.82
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.34
LogP ≤ 53.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-(1-cyclopropyl-6-fluorobenzimidazol-2-yl)thiophen-2-amine?
The IUPAC name of 5-(1-cyclopropyl-6-fluorobenzimidazol-2-yl)thiophen-2-amine (CID 62387448) is 5-(1-cyclopropyl-6-fluorobenzimidazol-2-yl)thiophen-2-amine.
What is the SMILES notation for 5-(1-cyclopropyl-6-fluorobenzimidazol-2-yl)thiophen-2-amine?
The canonical SMILES for 5-(1-cyclopropyl-6-fluorobenzimidazol-2-yl)thiophen-2-amine is Nc1ccc(-c2nc3ccc(F)cc3n2C2CC2)s1.
What is the InChIKey of 5-(1-cyclopropyl-6-fluorobenzimidazol-2-yl)thiophen-2-amine?
The InChIKey is HPVZRNIDQNNUEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12FN3S/c15-8-1-4-10-11(7-8)18(9-2-3-9)14(17-10)12-5-6-13(16)19-12/h1,4-7,9H,2-3,16H2.
What are the key properties of 5-(1-cyclopropyl-6-fluorobenzimidazol-2-yl)thiophen-2-amine?
5-(1-cyclopropyl-6-fluorobenzimidazol-2-yl)thiophen-2-amine has a molecular weight of 273.34 g/mol, XLogP of 3.82, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(1-cyclopropyl-6-fluorobenzimidazol-2-yl)thiophen-2-amine is sourced from PubChem (CID 62387448), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).