N-methyl-2-(7-methyl-3H-imidazo[1,2-a]benzimidazol-2-yl)ethanamine

C13H16N4 — CID 84625486

IUPACN-methyl-2-(7-methyl-3H-imidazo[1,2-a]benzimidazol-2-yl)ethanamine
SMILESCNCCc1cn2c(nc3ccc(C)cc32)[nH]1
InChIInChI=1S/C13H16N4/c1-9-3-4-11-12(7-9)17-8-10(5-6-14-2)15-13(17)16-11/h3-4,7-8,14H,5-6H2,1-2H3,(H,15,16)
InChIKeyLIZJVYRFCHVOIV-UHFFFAOYSA-N
MW228.30 g/mol
LogP1.89
Rot. Bonds3

About N-methyl-2-(7-methyl-3H-imidazo[1,2-a]benzimidazol-2-yl)ethanamine

N-methyl-2-(7-methyl-3H-imidazo[1,2-a]benzimidazol-2-yl)ethanamine (PubChem CID 84625486) has the molecular formula C13H16N4 and a molecular weight of 228.30 g/mol. Its IUPAC name is N-methyl-2-(7-methyl-3H-imidazo[1,2-a]benzimidazol-2-yl)ethanamine.

Molecular Properties

Compound NameN-methyl-2-(7-methyl-3H-imidazo[1,2-a]benzimidazol-2-yl)ethanamine
PubChem CID84625486
Molecular FormulaC13H16N4
Molecular Weight228.30 g/mol
Exact Mass228.14
IUPAC NameN-methyl-2-(7-methyl-3H-imidazo[1,2-a]benzimidazol-2-yl)ethanamine
SMILESCNCCc1cn2c(nc3ccc(C)cc32)[nH]1
InChIInChI=1S/C13H16N4/c1-9-3-4-11-12(7-9)17-8-10(5-6-14-2)15-13(17)16-11/h3-4,7-8,14H,5-6H2,1-2H3,(H,15,16)
InChIKeyLIZJVYRFCHVOIV-UHFFFAOYSA-N
XLogP1.89
TPSA45.12 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.30
LogP ≤ 51.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(5,7-difluoro-3H-imidazo[1,2-a]benzimidazol-2-yl)-N-methylethanamine
CID 84633689
3-(7-tert-butyl-3H-imidazo[1,2-a]benzimidazol-2-yl)propanoic acid
CID 84643554
6-methyl-3H-imidazo[1,2-a]benzimidazole-2-carboxylic acid
CID 84622077
2-(3,7-dimethylimidazo[1,5-a]pyridin-1-yl)-N-methylethanamine
CID 83832292
N-methyl-2-(6-methyl-1,3-benzothiazol-2-yl)ethanamine
CID 79143288
(6-tert-butyl-3H-imidazo[1,2-a]benzimidazol-2-yl)methanamine
CID 84630361
2-(4-chloro-6-methylquinazolin-2-yl)-N-methylethanamine
CID 105497222
N-methyl-2-(5-methyl-2,1-benzoxazol-3-yl)ethanamine
CID 105444370
1-(5-methoxy-3H-imidazo[1,2-a]benzimidazol-2-yl)-N-methylmethanamine
CID 84626072
N-methyl-1-(5-methylbenzotriazol-2-yl)methanamine
CID 70067388
(1-ethyl-6-methylbenzimidazol-2-yl)methanamine
CID 123207150
1-(1,5-dimethylbenzimidazol-2-yl)-N-methylmethanamine
CID 60785141

Frequently Asked Questions

What is the IUPAC name of N-methyl-2-(7-methyl-3H-imidazo[1,2-a]benzimidazol-2-yl)ethanamine?
The IUPAC name of N-methyl-2-(7-methyl-3H-imidazo[1,2-a]benzimidazol-2-yl)ethanamine (CID 84625486) is N-methyl-2-(7-methyl-3H-imidazo[1,2-a]benzimidazol-2-yl)ethanamine.
What is the SMILES notation for N-methyl-2-(7-methyl-3H-imidazo[1,2-a]benzimidazol-2-yl)ethanamine?
The canonical SMILES for N-methyl-2-(7-methyl-3H-imidazo[1,2-a]benzimidazol-2-yl)ethanamine is CNCCc1cn2c(nc3ccc(C)cc32)[nH]1.
What is the InChIKey of N-methyl-2-(7-methyl-3H-imidazo[1,2-a]benzimidazol-2-yl)ethanamine?
The InChIKey is LIZJVYRFCHVOIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N4/c1-9-3-4-11-12(7-9)17-8-10(5-6-14-2)15-13(17)16-11/h3-4,7-8,14H,5-6H2,1-2H3,(H,15,16).
What are the key properties of N-methyl-2-(7-methyl-3H-imidazo[1,2-a]benzimidazol-2-yl)ethanamine?
N-methyl-2-(7-methyl-3H-imidazo[1,2-a]benzimidazol-2-yl)ethanamine has a molecular weight of 228.30 g/mol, XLogP of 1.89, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-(7-methyl-3H-imidazo[1,2-a]benzimidazol-2-yl)ethanamine is sourced from PubChem (CID 84625486), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).