2-(6-fluoro-1-phenylbenzimidazol-2-yl)ethanamine

C15H14FN3 — CID 83421083

IUPAC2-(6-fluoro-1-phenylbenzimidazol-2-yl)ethanamine
SMILESNCCc1nc2ccc(F)cc2n1-c1ccccc1
InChIInChI=1S/C15H14FN3/c16-11-6-7-13-14(10-11)19(15(18-13)8-9-17)12-4-2-1-3-5-12/h1-7,10H,8-9,17H2
InChIKeyOLTOPGLCUXFRLL-UHFFFAOYSA-N
MW255.30 g/mol
LogP2.67
Rot. Bonds3

About 2-(6-fluoro-1-phenylbenzimidazol-2-yl)ethanamine

2-(6-fluoro-1-phenylbenzimidazol-2-yl)ethanamine (PubChem CID 83421083) has the molecular formula C15H14FN3 and a molecular weight of 255.30 g/mol. Its IUPAC name is 2-(6-fluoro-1-phenylbenzimidazol-2-yl)ethanamine.

Molecular Properties

Compound Name2-(6-fluoro-1-phenylbenzimidazol-2-yl)ethanamine
PubChem CID83421083
Molecular FormulaC15H14FN3
Molecular Weight255.30 g/mol
Exact Mass255.12
IUPAC Name2-(6-fluoro-1-phenylbenzimidazol-2-yl)ethanamine
SMILESNCCc1nc2ccc(F)cc2n1-c1ccccc1
InChIInChI=1S/C15H14FN3/c16-11-6-7-13-14(10-11)19(15(18-13)8-9-17)12-4-2-1-3-5-12/h1-7,10H,8-9,17H2
InChIKeyOLTOPGLCUXFRLL-UHFFFAOYSA-N
XLogP2.67
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.30
LogP ≤ 52.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

6-fluoro-2-(2-methoxyethyl)-1-phenylbenzimidazole
CID 123994693
6-fluoro-2-methyl-1-phenylbenzimidazole
CID 25216870
2-(2-chloroethyl)-1-(3-chlorophenyl)-6-fluorobenzimidazole
CID 63545555
1-(3-bromophenyl)-2-(2-chloroethyl)-6-fluorobenzimidazole
CID 63545191
4-amino-6-[2-(6-fluoro-1-phenylbenzimidazol-2-yl)ethylamino]pyrimidine-5-carbonitrile
CID 67464456
2-(2-chloroethyl)-1-(3,4-dichlorophenyl)-6-fluorobenzimidazole
CID 63546455
5-bromo-2-(chloromethyl)-6-fluoro-1-phenylbenzimidazole
CID 66085949
2-(2-aminoethyl)-6-iodo-3-phenylquinazolin-4-one
CID 90237321
2-(2-chloroethyl)-5-fluoro-6-methyl-1-phenylbenzimidazole
CID 103593331
3-[(6-fluoro-1-phenylbenzimidazol-2-yl)methyl]-7H-purin-3-ium-6-amine
CID 123372473
1-(6-fluoro-1-phenylbenzimidazol-2-yl)-2-phenylmethoxyethanamine
CID 77456172
6-[(1S)-1-(6-fluoro-1-phenylbenzimidazol-2-yl)ethyl]-1,3,5-triazine-2,4-diamine
CID 140590519

Frequently Asked Questions

What is the IUPAC name of 2-(6-fluoro-1-phenylbenzimidazol-2-yl)ethanamine?
The IUPAC name of 2-(6-fluoro-1-phenylbenzimidazol-2-yl)ethanamine (CID 83421083) is 2-(6-fluoro-1-phenylbenzimidazol-2-yl)ethanamine.
What is the SMILES notation for 2-(6-fluoro-1-phenylbenzimidazol-2-yl)ethanamine?
The canonical SMILES for 2-(6-fluoro-1-phenylbenzimidazol-2-yl)ethanamine is NCCc1nc2ccc(F)cc2n1-c1ccccc1.
What is the InChIKey of 2-(6-fluoro-1-phenylbenzimidazol-2-yl)ethanamine?
The InChIKey is OLTOPGLCUXFRLL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14FN3/c16-11-6-7-13-14(10-11)19(15(18-13)8-9-17)12-4-2-1-3-5-12/h1-7,10H,8-9,17H2.
What are the key properties of 2-(6-fluoro-1-phenylbenzimidazol-2-yl)ethanamine?
2-(6-fluoro-1-phenylbenzimidazol-2-yl)ethanamine has a molecular weight of 255.30 g/mol, XLogP of 2.67, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6-fluoro-1-phenylbenzimidazol-2-yl)ethanamine is sourced from PubChem (CID 83421083), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).