N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-1-methyl-4,5-dihydroimidazol-2-amine;hydroiodide

C12H15ClIN5 — CID 120969452

IUPACN-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-1-methyl-4,5-dihydroimidazol-2-amine;hydroiodide
SMILESCN1CCN=C1NCc1cn2cc(Cl)ccc2n1.I
InChIInChI=1S/C12H14ClN5.HI/c1-17-5-4-14-12(17)15-6-10-8-18-7-9(13)2-3-11(18)16-10;/h2-3,7-8H,4-6H2,1H3,(H,14,15);1H
InChIKeyUMYRPHYRBOZMTL-UHFFFAOYSA-N
MW391.64 g/mol
LogP2.00
Rot. Bonds2

About N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-1-methyl-4,5-dihydroimidazol-2-amine;hydroiodide

N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-1-methyl-4,5-dihydroimidazol-2-amine;hydroiodide (PubChem CID 120969452) has the molecular formula C12H15ClIN5 and a molecular weight of 391.64 g/mol. Its IUPAC name is N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-1-methyl-4,5-dihydroimidazol-2-amine;hydroiodide.

Molecular Properties

Compound NameN-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-1-methyl-4,5-dihydroimidazol-2-amine;hydroiodide
PubChem CID120969452
Molecular FormulaC12H15ClIN5
Molecular Weight391.64 g/mol
Exact Mass391.01
IUPAC NameN-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-1-methyl-4,5-dihydroimidazol-2-amine;hydroiodide
SMILESCN1CCN=C1NCc1cn2cc(Cl)ccc2n1.I
InChIInChI=1S/C12H14ClN5.HI/c1-17-5-4-14-12(17)15-6-10-8-18-7-9(13)2-3-11(18)16-10;/h2-3,7-8H,4-6H2,1H3,(H,14,15);1H
InChIKeyUMYRPHYRBOZMTL-UHFFFAOYSA-N
XLogP2.00
TPSA44.93 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500391.64
LogP ≤ 52.00
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

1-methyl-N-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]-4,5-dihydroimidazol-2-amine
CID 120970285
N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-4-methylpiperazin-1-amine
CID 83021792
N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]aniline
CID 78912513
N-(2-imidazo[1,2-a]pyridin-2-ylethyl)-1-methyl-4,5-dihydroimidazol-2-amine;hydroiodide
CID 120969414
N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-4-methoxyaniline
CID 78912735
N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-2-propan-2-ylaniline
CID 78914568
N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-4-iodoaniline
CID 78912750
1-(6-chloroimidazo[1,2-a]pyridin-2-yl)-N-[(2-methylpropan-2-yl)oxy]methanamine
CID 82723556
2-chloro-N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-5-methylaniline
CID 107634826
N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-3,3-dimethylbutan-2-amine
CID 115625717
N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-2,5-difluoroaniline
CID 78914191
N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-3-pyrrolidin-1-ylpropan-1-amine
CID 78913138

Frequently Asked Questions

What is the IUPAC name of N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-1-methyl-4,5-dihydroimidazol-2-amine;hydroiodide?
The IUPAC name of N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-1-methyl-4,5-dihydroimidazol-2-amine;hydroiodide (CID 120969452) is N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-1-methyl-4,5-dihydroimidazol-2-amine;hydroiodide.
What is the SMILES notation for N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-1-methyl-4,5-dihydroimidazol-2-amine;hydroiodide?
The canonical SMILES for N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-1-methyl-4,5-dihydroimidazol-2-amine;hydroiodide is CN1CCN=C1NCc1cn2cc(Cl)ccc2n1.I.
What is the InChIKey of N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-1-methyl-4,5-dihydroimidazol-2-amine;hydroiodide?
The InChIKey is UMYRPHYRBOZMTL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14ClN5.HI/c1-17-5-4-14-12(17)15-6-10-8-18-7-9(13)2-3-11(18)16-10;/h2-3,7-8H,4-6H2,1H3,(H,14,15);1H.
What are the key properties of N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-1-methyl-4,5-dihydroimidazol-2-amine;hydroiodide?
N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-1-methyl-4,5-dihydroimidazol-2-amine;hydroiodide has a molecular weight of 391.64 g/mol, XLogP of 2.00, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-1-methyl-4,5-dihydroimidazol-2-amine;hydroiodide is sourced from PubChem (CID 120969452), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).