1-ethyl-4-methyl-6-(1-methylbenzimidazol-2-yl)-2-propylbenzimidazole

C21H24N4 — CID 143854149

IUPAC1-ethyl-4-methyl-6-(1-methylbenzimidazol-2-yl)-2-propylbenzimidazole
SMILESCCCc1nc2c(C)cc(-c3nc4ccccc4n3C)cc2n1CC
InChIInChI=1S/C21H24N4/c1-5-9-19-23-20-14(3)12-15(13-18(20)25(19)6-2)21-22-16-10-7-8-11-17(16)24(21)4/h7-8,10-13H,5-6,9H2,1-4H3
InChIKeyBTDQOHVELANKBB-UHFFFAOYSA-N
MW332.45 g/mol
LogP4.87
Rot. Bonds4

About 1-ethyl-4-methyl-6-(1-methylbenzimidazol-2-yl)-2-propylbenzimidazole

1-ethyl-4-methyl-6-(1-methylbenzimidazol-2-yl)-2-propylbenzimidazole (PubChem CID 143854149) has the molecular formula C21H24N4 and a molecular weight of 332.45 g/mol. Its IUPAC name is 1-ethyl-4-methyl-6-(1-methylbenzimidazol-2-yl)-2-propylbenzimidazole.

Molecular Properties

Compound Name1-ethyl-4-methyl-6-(1-methylbenzimidazol-2-yl)-2-propylbenzimidazole
PubChem CID143854149
Molecular FormulaC21H24N4
Molecular Weight332.45 g/mol
Exact Mass332.20
IUPAC Name1-ethyl-4-methyl-6-(1-methylbenzimidazol-2-yl)-2-propylbenzimidazole
SMILESCCCc1nc2c(C)cc(-c3nc4ccccc4n3C)cc2n1CC
InChIInChI=1S/C21H24N4/c1-5-9-19-23-20-14(3)12-15(13-18(20)25(19)6-2)21-22-16-10-7-8-11-17(16)24(21)4/h7-8,10-13H,5-6,9H2,1-4H3
InChIKeyBTDQOHVELANKBB-UHFFFAOYSA-N
XLogP4.87
TPSA35.64 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.45
LogP ≤ 54.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

2-[4-[[4-methyl-6-(1-methylbenzimidazol-2-yl)-2-propylbenzimidazol-1-yl]methyl]phenyl]benzaldehyde
CID 15295804
1-[2-[4-[[4-methyl-6-(1-methylbenzimidazol-2-yl)-2-propylbenzimidazol-1-yl]methyl]phenyl]phenyl]ethanone
CID 59256856
2-(2-cyanophenyl)-5-[[4-methyl-6-(1-methylbenzimidazol-2-yl)-2-propylbenzimidazol-1-yl]methyl]benzonitrile
CID 68741725
2-[4-[[4-methyl-6-(1-methylbenzimidazol-2-yl)-2-propylbenzimidazol-1-yl]methyl]phenyl]benzoic acid;hydrobromide
CID 11956639
CID 174855480
CID 174855480
2-[4-[[4-methyl-6-(1-methylbenzimidazol-2-yl)-2-propylbenzimidazol-1-yl]methyl]phenyl]benzoic acid;oxalic acid
CID 68847152
6-[4-[2-[4-methyl-6-(1-methylbenzimidazol-2-yl)-2-propylbenzimidazol-1-yl]ethyl]phenyl]cyclohexa-2,4-diene-1-carboxylic acid
CID 90796779
1-(4-fluorophenyl)sulfonyl-4-methyl-6-(1-methylbenzimidazol-2-yl)-2-propylbenzimidazole
CID 118737474
phenyl 3-[4-[[4-methyl-6-(1-methylbenzimidazol-2-yl)-2-propylbenzimidazol-1-yl]methyl]phenyl]prop-2-ynoate
CID 68991535
(Z)-but-2-enedioic acid;bis(2-[4-[[4-methyl-6-(1-methylbenzimidazol-2-yl)-2-propylbenzimidazol-1-yl]methyl]phenyl]benzoic acid)
CID 24824101
tert-butyl [2-[4-[[4-methyl-6-(1-methylbenzimidazol-2-yl)-2-propylbenzimidazol-1-yl]methyl]phenyl]phenyl] carbonate
CID 69115483
tert-butyl 2-[4-[[4-methyl-6-(1-methylbenzimidazol-2-yl)-2-propylbenzimidazol-1-yl]methyl]phenyl]benzoate;2-[4-[[4-methyl-6-(1-methylbenzimidazol-2-yl)-2-propylbenzimidazol-1-yl]methyl]phenyl]benzoic acid;molecular iodine
CID 169427877

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-4-methyl-6-(1-methylbenzimidazol-2-yl)-2-propylbenzimidazole?
The IUPAC name of 1-ethyl-4-methyl-6-(1-methylbenzimidazol-2-yl)-2-propylbenzimidazole (CID 143854149) is 1-ethyl-4-methyl-6-(1-methylbenzimidazol-2-yl)-2-propylbenzimidazole.
What is the SMILES notation for 1-ethyl-4-methyl-6-(1-methylbenzimidazol-2-yl)-2-propylbenzimidazole?
The canonical SMILES for 1-ethyl-4-methyl-6-(1-methylbenzimidazol-2-yl)-2-propylbenzimidazole is CCCc1nc2c(C)cc(-c3nc4ccccc4n3C)cc2n1CC.
What is the InChIKey of 1-ethyl-4-methyl-6-(1-methylbenzimidazol-2-yl)-2-propylbenzimidazole?
The InChIKey is BTDQOHVELANKBB-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H24N4/c1-5-9-19-23-20-14(3)12-15(13-18(20)25(19)6-2)21-22-16-10-7-8-11-17(16)24(21)4/h7-8,10-13H,5-6,9H2,1-4H3.
What are the key properties of 1-ethyl-4-methyl-6-(1-methylbenzimidazol-2-yl)-2-propylbenzimidazole?
1-ethyl-4-methyl-6-(1-methylbenzimidazol-2-yl)-2-propylbenzimidazole has a molecular weight of 332.45 g/mol, XLogP of 4.87, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-4-methyl-6-(1-methylbenzimidazol-2-yl)-2-propylbenzimidazole is sourced from PubChem (CID 143854149), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).