2-(2-ethylbenzimidazol-1-yl)-2-(2-fluorophenyl)ethanamine

C17H18FN3 — CID 63105995

IUPAC2-(2-ethylbenzimidazol-1-yl)-2-(2-fluorophenyl)ethanamine
SMILESCCc1nc2ccccc2n1C(CN)c1ccccc1F
InChIInChI=1S/C17H18FN3/c1-2-17-20-14-9-5-6-10-15(14)21(17)16(11-19)12-7-3-4-8-13(12)18/h3-10,16H,2,11,19H2,1H3
InChIKeyUWGOUZHNRKBCOG-UHFFFAOYSA-N
MW283.35 g/mol
LogP3.29
Rot. Bonds4

About 2-(2-ethylbenzimidazol-1-yl)-2-(2-fluorophenyl)ethanamine

2-(2-ethylbenzimidazol-1-yl)-2-(2-fluorophenyl)ethanamine (PubChem CID 63105995) has the molecular formula C17H18FN3 and a molecular weight of 283.35 g/mol. Its IUPAC name is 2-(2-ethylbenzimidazol-1-yl)-2-(2-fluorophenyl)ethanamine.

Molecular Properties

Compound Name2-(2-ethylbenzimidazol-1-yl)-2-(2-fluorophenyl)ethanamine
PubChem CID63105995
Molecular FormulaC17H18FN3
Molecular Weight283.35 g/mol
Exact Mass283.15
IUPAC Name2-(2-ethylbenzimidazol-1-yl)-2-(2-fluorophenyl)ethanamine
SMILESCCc1nc2ccccc2n1C(CN)c1ccccc1F
InChIInChI=1S/C17H18FN3/c1-2-17-20-14-9-5-6-10-15(14)21(17)16(11-19)12-7-3-4-8-13(12)18/h3-10,16H,2,11,19H2,1H3
InChIKeyUWGOUZHNRKBCOG-UHFFFAOYSA-N
XLogP3.29
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.35
LogP ≤ 53.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2-ethylbenzimidazol-1-yl)-2-phenylethanamine
CID 63105228
2-[1-[(2R)-butan-2-yl]benzimidazol-2-yl]ethanamine
CID 51970586
1-but-3-en-2-yl-2-ethylbenzimidazole
CID 116622499
2-ethyl-1-[(1R)-1-phenylethyl]benzimidazole
CID 962439
(2S)-2-(2-ethylbenzimidazol-1-yl)propanamide
CID 94671511
2-(2-butylbenzimidazol-1-yl)propan-1-amine
CID 82144544
2-[(1-propan-2-ylbenzimidazol-2-yl)methyl]butan-1-amine
CID 81073466
2-(5-methylthiophen-2-yl)-2-(2-propylbenzimidazol-1-yl)ethanamine
CID 115970610
3-(2-ethylbenzimidazol-1-yl)-2-methylbutanehydrazide
CID 79405139
2-(3-methylthiophen-2-yl)-2-(2-propylbenzimidazol-1-yl)ethanamine
CID 115970638
2-(2-fluorophenyl)-2-(4-propan-2-ylpiperazin-1-yl)ethanamine
CID 43585183
[2-[(1-propan-2-ylbenzimidazol-2-yl)methyl]phenyl]methanamine
CID 81312674

Frequently Asked Questions

What is the IUPAC name of 2-(2-ethylbenzimidazol-1-yl)-2-(2-fluorophenyl)ethanamine?
The IUPAC name of 2-(2-ethylbenzimidazol-1-yl)-2-(2-fluorophenyl)ethanamine (CID 63105995) is 2-(2-ethylbenzimidazol-1-yl)-2-(2-fluorophenyl)ethanamine.
What is the SMILES notation for 2-(2-ethylbenzimidazol-1-yl)-2-(2-fluorophenyl)ethanamine?
The canonical SMILES for 2-(2-ethylbenzimidazol-1-yl)-2-(2-fluorophenyl)ethanamine is CCc1nc2ccccc2n1C(CN)c1ccccc1F.
What is the InChIKey of 2-(2-ethylbenzimidazol-1-yl)-2-(2-fluorophenyl)ethanamine?
The InChIKey is UWGOUZHNRKBCOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18FN3/c1-2-17-20-14-9-5-6-10-15(14)21(17)16(11-19)12-7-3-4-8-13(12)18/h3-10,16H,2,11,19H2,1H3.
What are the key properties of 2-(2-ethylbenzimidazol-1-yl)-2-(2-fluorophenyl)ethanamine?
2-(2-ethylbenzimidazol-1-yl)-2-(2-fluorophenyl)ethanamine has a molecular weight of 283.35 g/mol, XLogP of 3.29, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-ethylbenzimidazol-1-yl)-2-(2-fluorophenyl)ethanamine is sourced from PubChem (CID 63105995), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).