2-[5-ethyl-1-(1-phenylethyl)benzimidazol-2-yl]ethanamine

C19H23N3 — CID 82333474

IUPAC2-[5-ethyl-1-(1-phenylethyl)benzimidazol-2-yl]ethanamine
SMILESCCc1ccc2c(c1)nc(CCN)n2C(C)c1ccccc1
InChIInChI=1S/C19H23N3/c1-3-15-9-10-18-17(13-15)21-19(11-12-20)22(18)14(2)16-7-5-4-6-8-16/h4-10,13-14H,3,11-12,20H2,1-2H3
InChIKeyCMHRHJKVNUIRGI-UHFFFAOYSA-N
MW293.41 g/mol
LogP3.71
Rot. Bonds5

About 2-[5-ethyl-1-(1-phenylethyl)benzimidazol-2-yl]ethanamine

2-[5-ethyl-1-(1-phenylethyl)benzimidazol-2-yl]ethanamine (PubChem CID 82333474) has the molecular formula C19H23N3 and a molecular weight of 293.41 g/mol. Its IUPAC name is 2-[5-ethyl-1-(1-phenylethyl)benzimidazol-2-yl]ethanamine.

Molecular Properties

Compound Name2-[5-ethyl-1-(1-phenylethyl)benzimidazol-2-yl]ethanamine
PubChem CID82333474
Molecular FormulaC19H23N3
Molecular Weight293.41 g/mol
Exact Mass293.19
IUPAC Name2-[5-ethyl-1-(1-phenylethyl)benzimidazol-2-yl]ethanamine
SMILESCCc1ccc2c(c1)nc(CCN)n2C(C)c1ccccc1
InChIInChI=1S/C19H23N3/c1-3-15-9-10-18-17(13-15)21-19(11-12-20)22(18)14(2)16-7-5-4-6-8-16/h4-10,13-14H,3,11-12,20H2,1-2H3
InChIKeyCMHRHJKVNUIRGI-UHFFFAOYSA-N
XLogP3.71
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.41
LogP ≤ 53.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(5-ethyl-1-propan-2-ylbenzimidazol-2-yl)ethanamine
CID 82333475
(5-ethyl-1-propan-2-ylbenzimidazol-2-yl)methanamine
CID 82333500
2-(1,5-diethylbenzimidazol-2-yl)ethanamine
CID 82333476
2-ethyl-1-[(1R)-1-phenylethyl]benzimidazole
CID 962439
2-(2-chloroethyl)-1-(1-phenylethyl)benzimidazole
CID 43666303
2-[5-ethyl-1-[(2-fluorophenyl)methyl]benzimidazol-2-yl]ethanamine
CID 82333467
[5-methoxy-1-(1-phenylethyl)benzimidazol-2-yl]methanamine
CID 82334325
1-[1-(4-chlorophenyl)ethyl]-2-ethylbenzimidazol-5-amine
CID 62508046
2-(chloromethyl)-5-fluoro-1-(1-phenylethyl)benzimidazole
CID 43660125
2-(5-chloro-1-propan-2-ylbenzimidazol-2-yl)ethanamine
CID 46310662
2-(5-methyl-1-propan-2-ylbenzimidazol-2-yl)ethanamine
CID 60785148
2-[1-[(2R)-butan-2-yl]benzimidazol-2-yl]ethanamine
CID 51970586

Frequently Asked Questions

What is the IUPAC name of 2-[5-ethyl-1-(1-phenylethyl)benzimidazol-2-yl]ethanamine?
The IUPAC name of 2-[5-ethyl-1-(1-phenylethyl)benzimidazol-2-yl]ethanamine (CID 82333474) is 2-[5-ethyl-1-(1-phenylethyl)benzimidazol-2-yl]ethanamine.
What is the SMILES notation for 2-[5-ethyl-1-(1-phenylethyl)benzimidazol-2-yl]ethanamine?
The canonical SMILES for 2-[5-ethyl-1-(1-phenylethyl)benzimidazol-2-yl]ethanamine is CCc1ccc2c(c1)nc(CCN)n2C(C)c1ccccc1.
What is the InChIKey of 2-[5-ethyl-1-(1-phenylethyl)benzimidazol-2-yl]ethanamine?
The InChIKey is CMHRHJKVNUIRGI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N3/c1-3-15-9-10-18-17(13-15)21-19(11-12-20)22(18)14(2)16-7-5-4-6-8-16/h4-10,13-14H,3,11-12,20H2,1-2H3.
What are the key properties of 2-[5-ethyl-1-(1-phenylethyl)benzimidazol-2-yl]ethanamine?
2-[5-ethyl-1-(1-phenylethyl)benzimidazol-2-yl]ethanamine has a molecular weight of 293.41 g/mol, XLogP of 3.71, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[5-ethyl-1-(1-phenylethyl)benzimidazol-2-yl]ethanamine is sourced from PubChem (CID 82333474), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).