(5-ethyl-3H-imidazo[1,2-a]benzimidazol-2-yl)methanamine

C12H14N4 — CID 84621934

IUPAC(5-ethyl-3H-imidazo[1,2-a]benzimidazol-2-yl)methanamine
SMILESCCc1cccc2c1nc1[nH]c(CN)cn12
InChIInChI=1S/C12H14N4/c1-2-8-4-3-5-10-11(8)15-12-14-9(6-13)7-16(10)12/h3-5,7H,2,6,13H2,1H3,(H,14,15)
InChIKeySYVIAYOTICKDNN-UHFFFAOYSA-N
MW214.27 g/mol
LogP1.84
Rot. Bonds2

About (5-ethyl-3H-imidazo[1,2-a]benzimidazol-2-yl)methanamine

(5-ethyl-3H-imidazo[1,2-a]benzimidazol-2-yl)methanamine (PubChem CID 84621934) has the molecular formula C12H14N4 and a molecular weight of 214.27 g/mol. Its IUPAC name is (5-ethyl-3H-imidazo[1,2-a]benzimidazol-2-yl)methanamine.

Molecular Properties

Compound Name(5-ethyl-3H-imidazo[1,2-a]benzimidazol-2-yl)methanamine
PubChem CID84621934
Molecular FormulaC12H14N4
Molecular Weight214.27 g/mol
Exact Mass214.12
IUPAC Name(5-ethyl-3H-imidazo[1,2-a]benzimidazol-2-yl)methanamine
SMILESCCc1cccc2c1nc1[nH]c(CN)cn12
InChIInChI=1S/C12H14N4/c1-2-8-4-3-5-10-11(8)15-12-14-9(6-13)7-16(10)12/h3-5,7H,2,6,13H2,1H3,(H,14,15)
InChIKeySYVIAYOTICKDNN-UHFFFAOYSA-N
XLogP1.84
TPSA59.11 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.27
LogP ≤ 51.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(5-tert-butyl-3H-imidazo[1,2-a]benzimidazol-2-yl)methanamine
CID 84630370
(1-bromo-5-ethyl-3H-imidazo[1,2-a]benzimidazol-2-yl)methanamine
CID 84643908
1-(5-methoxy-3H-imidazo[1,2-a]benzimidazol-2-yl)-N-methylmethanamine
CID 84626072
(6-tert-butyl-3H-imidazo[1,2-a]benzimidazol-2-yl)methanamine
CID 84630361
azane;2,4-diethyl-1-methylbenzimidazole
CID 69090242
(3-ethyl-1-methylindol-4-yl)methanamine
CID 115017614
3-(1-bromo-5-ethyl-3H-imidazo[1,2-a]benzimidazol-2-yl)propanoic acid
CID 84646573
4-ethyl-1-methyl-2-(3-methylbut-2-en-2-yl)benzimidazole
CID 118336706
(1-methyl-2-pentan-3-ylbenzimidazol-4-yl)methanamine
CID 113445267
6-ethyl-N-propan-2-yl-[1,2,4]triazolo[4,3-a]quinoxalin-4-amine
CID 70510773
[4-(aminomethyl)-1-methylbenzimidazol-2-yl]methanol
CID 104721498
[2-(3-ethoxypropyl)-1-methylbenzimidazol-4-yl]methanamine
CID 104721481

Frequently Asked Questions

What is the IUPAC name of (5-ethyl-3H-imidazo[1,2-a]benzimidazol-2-yl)methanamine?
The IUPAC name of (5-ethyl-3H-imidazo[1,2-a]benzimidazol-2-yl)methanamine (CID 84621934) is (5-ethyl-3H-imidazo[1,2-a]benzimidazol-2-yl)methanamine.
What is the SMILES notation for (5-ethyl-3H-imidazo[1,2-a]benzimidazol-2-yl)methanamine?
The canonical SMILES for (5-ethyl-3H-imidazo[1,2-a]benzimidazol-2-yl)methanamine is CCc1cccc2c1nc1[nH]c(CN)cn12.
What is the InChIKey of (5-ethyl-3H-imidazo[1,2-a]benzimidazol-2-yl)methanamine?
The InChIKey is SYVIAYOTICKDNN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N4/c1-2-8-4-3-5-10-11(8)15-12-14-9(6-13)7-16(10)12/h3-5,7H,2,6,13H2,1H3,(H,14,15).
What are the key properties of (5-ethyl-3H-imidazo[1,2-a]benzimidazol-2-yl)methanamine?
(5-ethyl-3H-imidazo[1,2-a]benzimidazol-2-yl)methanamine has a molecular weight of 214.27 g/mol, XLogP of 1.84, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (5-ethyl-3H-imidazo[1,2-a]benzimidazol-2-yl)methanamine is sourced from PubChem (CID 84621934), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).