2-(2,3-dihydro-1H-indol-2-yl)-1-ethylbenzimidazole

C17H17N3 — CID 43325776

IUPAC2-(2,3-dihydro-1H-indol-2-yl)-1-ethylbenzimidazole
SMILESCCn1c(C2Cc3ccccc3N2)nc2ccccc21
InChIInChI=1S/C17H17N3/c1-2-20-16-10-6-5-9-14(16)19-17(20)15-11-12-7-3-4-8-13(12)18-15/h3-10,15,18H,2,11H2,1H3
InChIKeyDNYXJFFLRANUFJ-UHFFFAOYSA-N
MW263.34 g/mol
LogP3.77
Rot. Bonds2

About 2-(2,3-dihydro-1H-indol-2-yl)-1-ethylbenzimidazole

2-(2,3-dihydro-1H-indol-2-yl)-1-ethylbenzimidazole (PubChem CID 43325776) has the molecular formula C17H17N3 and a molecular weight of 263.34 g/mol. Its IUPAC name is 2-(2,3-dihydro-1H-indol-2-yl)-1-ethylbenzimidazole.

Molecular Properties

Compound Name2-(2,3-dihydro-1H-indol-2-yl)-1-ethylbenzimidazole
PubChem CID43325776
Molecular FormulaC17H17N3
Molecular Weight263.34 g/mol
Exact Mass263.14
IUPAC Name2-(2,3-dihydro-1H-indol-2-yl)-1-ethylbenzimidazole
SMILESCCn1c(C2Cc3ccccc3N2)nc2ccccc21
InChIInChI=1S/C17H17N3/c1-2-20-16-10-6-5-9-14(16)19-17(20)15-11-12-7-3-4-8-13(12)18-15/h3-10,15,18H,2,11H2,1H3
InChIKeyDNYXJFFLRANUFJ-UHFFFAOYSA-N
XLogP3.77
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.34
LogP ≤ 53.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

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CID 20983587
4-[(2R)-2-(1-ethylbenzimidazol-2-yl)pyrrolidine-1-carbonyl]benzonitrile
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(4-bromo-3-fluorophenyl)-[2-(1-ethylbenzimidazol-2-yl)pyrrolidin-1-yl]methanone
CID 60620906
2-(4-methyl-1,2,4-triazol-3-yl)-2,3-dihydro-1H-indole
CID 62694070
1-ethyl-2-[1-(2-ethylsulfonylethyl)pyrrolidin-2-yl]benzimidazole
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(2R)-1-[2-(1-ethylbenzimidazol-2-yl)pyrrolidin-1-yl]butan-2-ol
CID 111970121
2-(1,2,3,3a,4,5,6,6a-octahydrocyclopenta[c]pyrrol-3-yl)-1-ethylbenzimidazole
CID 102892511
1-ethyl-4-(1-ethylbenzimidazol-2-yl)pyrrolidin-2-one
CID 17002372
1-ethyl-2-[1-(2-pyrazol-1-ylethyl)pyrrolidin-2-yl]benzimidazole
CID 71859415
5-[(2S)-2-(1-ethylbenzimidazol-2-yl)pyrrolidine-1-carbonyl]pyridine-2-carboxylic acid
CID 124684072
1-[2-(1-ethylbenzimidazol-2-yl)pyrrolidin-1-yl]-2-pyrrolidin-2-ylethanone
CID 119872644
4-[2-(1-ethylbenzimidazol-2-yl)pyrrolidin-1-yl]-2-methyl-5,6,7,8-tetrahydroquinazoline
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Frequently Asked Questions

What is the IUPAC name of 2-(2,3-dihydro-1H-indol-2-yl)-1-ethylbenzimidazole?
The IUPAC name of 2-(2,3-dihydro-1H-indol-2-yl)-1-ethylbenzimidazole (CID 43325776) is 2-(2,3-dihydro-1H-indol-2-yl)-1-ethylbenzimidazole.
What is the SMILES notation for 2-(2,3-dihydro-1H-indol-2-yl)-1-ethylbenzimidazole?
The canonical SMILES for 2-(2,3-dihydro-1H-indol-2-yl)-1-ethylbenzimidazole is CCn1c(C2Cc3ccccc3N2)nc2ccccc21.
What is the InChIKey of 2-(2,3-dihydro-1H-indol-2-yl)-1-ethylbenzimidazole?
The InChIKey is DNYXJFFLRANUFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17N3/c1-2-20-16-10-6-5-9-14(16)19-17(20)15-11-12-7-3-4-8-13(12)18-15/h3-10,15,18H,2,11H2,1H3.
What are the key properties of 2-(2,3-dihydro-1H-indol-2-yl)-1-ethylbenzimidazole?
2-(2,3-dihydro-1H-indol-2-yl)-1-ethylbenzimidazole has a molecular weight of 263.34 g/mol, XLogP of 3.77, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,3-dihydro-1H-indol-2-yl)-1-ethylbenzimidazole is sourced from PubChem (CID 43325776), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).