N-(2-imidazo[1,2-a]pyridin-2-ylethyl)-1-methyl-4,5-dihydroimidazol-2-amine;hydroiodide

C13H18IN5 — CID 120969414

IUPACN-(2-imidazo[1,2-a]pyridin-2-ylethyl)-1-methyl-4,5-dihydroimidazol-2-amine;hydroiodide
SMILESCN1CCN=C1NCCc1cn2ccccc2n1.I
InChIInChI=1S/C13H17N5.HI/c1-17-9-7-15-13(17)14-6-5-11-10-18-8-3-2-4-12(18)16-11;/h2-4,8,10H,5-7,9H2,1H3,(H,14,15);1H
InChIKeyLFCKZISJKQOJHR-UHFFFAOYSA-N
MW371.23 g/mol
LogP1.39
Rot. Bonds3

About N-(2-imidazo[1,2-a]pyridin-2-ylethyl)-1-methyl-4,5-dihydroimidazol-2-amine;hydroiodide

N-(2-imidazo[1,2-a]pyridin-2-ylethyl)-1-methyl-4,5-dihydroimidazol-2-amine;hydroiodide (PubChem CID 120969414) has the molecular formula C13H18IN5 and a molecular weight of 371.23 g/mol. Its IUPAC name is N-(2-imidazo[1,2-a]pyridin-2-ylethyl)-1-methyl-4,5-dihydroimidazol-2-amine;hydroiodide.

Molecular Properties

Compound NameN-(2-imidazo[1,2-a]pyridin-2-ylethyl)-1-methyl-4,5-dihydroimidazol-2-amine;hydroiodide
PubChem CID120969414
Molecular FormulaC13H18IN5
Molecular Weight371.23 g/mol
Exact Mass371.06
IUPAC NameN-(2-imidazo[1,2-a]pyridin-2-ylethyl)-1-methyl-4,5-dihydroimidazol-2-amine;hydroiodide
SMILESCN1CCN=C1NCCc1cn2ccccc2n1.I
InChIInChI=1S/C13H17N5.HI/c1-17-9-7-15-13(17)14-6-5-11-10-18-8-3-2-4-12(18)16-11;/h2-4,8,10H,5-7,9H2,1H3,(H,14,15);1H
InChIKeyLFCKZISJKQOJHR-UHFFFAOYSA-N
XLogP1.39
TPSA44.93 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500371.23
LogP ≤ 51.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'iodine', 'substructure': 'N/A'}

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Related Compounds

N-(2-imidazo[1,2-a]pyridin-2-ylethyl)-4,6-dimethylpyrimidin-2-amine
CID 31537504
N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-1-methyl-4,5-dihydroimidazol-2-amine;hydroiodide
CID 120969452
1-methyl-N-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]-4,5-dihydroimidazol-2-amine
CID 120970285
N-(2-imidazo[1,2-a]pyridin-2-ylethyl)-5-iodopyridin-2-amine
CID 166212596
N-(2-imidazo[1,2-a]pyridin-2-ylethyl)-N'-methyl-2-azaspiro[4.5]decane-2-carboximidamide;hydroiodide
CID 111745047
1-methyl-N-(2-pyridin-4-ylethyl)-4,5-dihydroimidazol-2-amine;hydroiodide
CID 120971012
1-methyl-N-[2-(4-methylphenyl)ethyl]-4,5-dihydroimidazol-2-amine;hydroiodide
CID 120971314
4-(2-hydroxyphenyl)-N-(2-imidazo[1,2-a]pyridin-2-ylethyl)-N'-methylpiperazine-1-carboximidamide;hydroiodide
CID 111184637
N-(2-imidazo[1,2-a]pyridin-2-ylethyl)-4-methyl-1,4-diazepane-1-carboxamide
CID 71893430
1-(2-imidazo[1,2-a]pyridin-2-ylethyl)-2,3-dimethylguanidine;hydroiodide
CID 110914604
2-imidazo[1,2-a]pyridin-2-ylethanamine
CID 7536516
N-(2-imidazo[1,2-a]pyridin-2-ylethyl)-3-(2-methoxyethyl)-1,2,4-thiadiazol-5-amine
CID 133370037

Frequently Asked Questions

What is the IUPAC name of N-(2-imidazo[1,2-a]pyridin-2-ylethyl)-1-methyl-4,5-dihydroimidazol-2-amine;hydroiodide?
The IUPAC name of N-(2-imidazo[1,2-a]pyridin-2-ylethyl)-1-methyl-4,5-dihydroimidazol-2-amine;hydroiodide (CID 120969414) is N-(2-imidazo[1,2-a]pyridin-2-ylethyl)-1-methyl-4,5-dihydroimidazol-2-amine;hydroiodide.
What is the SMILES notation for N-(2-imidazo[1,2-a]pyridin-2-ylethyl)-1-methyl-4,5-dihydroimidazol-2-amine;hydroiodide?
The canonical SMILES for N-(2-imidazo[1,2-a]pyridin-2-ylethyl)-1-methyl-4,5-dihydroimidazol-2-amine;hydroiodide is CN1CCN=C1NCCc1cn2ccccc2n1.I.
What is the InChIKey of N-(2-imidazo[1,2-a]pyridin-2-ylethyl)-1-methyl-4,5-dihydroimidazol-2-amine;hydroiodide?
The InChIKey is LFCKZISJKQOJHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17N5.HI/c1-17-9-7-15-13(17)14-6-5-11-10-18-8-3-2-4-12(18)16-11;/h2-4,8,10H,5-7,9H2,1H3,(H,14,15);1H.
What are the key properties of N-(2-imidazo[1,2-a]pyridin-2-ylethyl)-1-methyl-4,5-dihydroimidazol-2-amine;hydroiodide?
N-(2-imidazo[1,2-a]pyridin-2-ylethyl)-1-methyl-4,5-dihydroimidazol-2-amine;hydroiodide has a molecular weight of 371.23 g/mol, XLogP of 1.39, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-imidazo[1,2-a]pyridin-2-ylethyl)-1-methyl-4,5-dihydroimidazol-2-amine;hydroiodide is sourced from PubChem (CID 120969414), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).