N',3-dimethyl-N-[2-(8-methylimidazo[1,2-a]pyridin-2-yl)ethyl]piperidine-1-carboximidamide;hydroiodide

C18H28IN5 — CID 102559379

IUPACN',3-dimethyl-N-[2-(8-methylimidazo[1,2-a]pyridin-2-yl)ethyl]piperidine-1-carboximidamide;hydroiodide
SMILESC/N=C(/NCCc1cn2cccc(C)c2n1)N1CCCC(C)C1.I
InChIInChI=1S/C18H27N5.HI/c1-14-6-4-11-23(12-14)18(19-3)20-9-8-16-13-22-10-5-7-15(2)17(22)21-16;/h5,7,10,13-14H,4,6,8-9,11-12H2,1-3H3,(H,19,20);1H
InChIKeySGMDUFXFMNYZEM-UHFFFAOYSA-N
MW441.36 g/mol
LogP3.11
Rot. Bonds3

About N',3-dimethyl-N-[2-(8-methylimidazo[1,2-a]pyridin-2-yl)ethyl]piperidine-1-carboximidamide;hydroiodide

N',3-dimethyl-N-[2-(8-methylimidazo[1,2-a]pyridin-2-yl)ethyl]piperidine-1-carboximidamide;hydroiodide (PubChem CID 102559379) has the molecular formula C18H28IN5 and a molecular weight of 441.36 g/mol. Its IUPAC name is N',3-dimethyl-N-[2-(8-methylimidazo[1,2-a]pyridin-2-yl)ethyl]piperidine-1-carboximidamide;hydroiodide.

Molecular Properties

Compound NameN',3-dimethyl-N-[2-(8-methylimidazo[1,2-a]pyridin-2-yl)ethyl]piperidine-1-carboximidamide;hydroiodide
PubChem CID102559379
Molecular FormulaC18H28IN5
Molecular Weight441.36 g/mol
Exact Mass441.14
IUPAC NameN',3-dimethyl-N-[2-(8-methylimidazo[1,2-a]pyridin-2-yl)ethyl]piperidine-1-carboximidamide;hydroiodide
SMILESC/N=C(/NCCc1cn2cccc(C)c2n1)N1CCCC(C)C1.I
InChIInChI=1S/C18H27N5.HI/c1-14-6-4-11-23(12-14)18(19-3)20-9-8-16-13-22-10-5-7-15(2)17(22)21-16;/h5,7,10,13-14H,4,6,8-9,11-12H2,1-3H3,(H,19,20);1H
InChIKeySGMDUFXFMNYZEM-UHFFFAOYSA-N
XLogP3.11
TPSA44.93 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500441.36
LogP ≤ 53.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}, {'alert_name': 'iodine', 'substructure': 'N/A'}

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Related Compounds

N',2,2-trimethyl-N-[2-(8-methylimidazo[1,2-a]pyridin-2-yl)ethyl]thiomorpholine-4-carboximidamide
CID 109487695
2-methyl-1-[2-(8-methylimidazo[1,2-a]pyridin-2-yl)ethyl]-3-(2-phenylethyl)guanidine;hydroiodide
CID 111834882
1-heptan-2-yl-2-methyl-3-[2-(8-methylimidazo[1,2-a]pyridin-2-yl)ethyl]guanidine;hydroiodide
CID 111835870
N',3-dimethyl-N-(2-pyridin-3-ylethyl)piperidine-1-carboximidamide
CID 111145936
1-ethyl-2-[(1-ethylpyrrolidin-2-yl)methyl]-3-[2-(8-methylimidazo[1,2-a]pyridin-2-yl)ethyl]guanidine;hydroiodide
CID 111837266
1-ethyl-3-[2-(8-methylimidazo[1,2-a]pyridin-2-yl)ethyl]-2-[3-(2-methylpiperidin-1-yl)propyl]guanidine;hydroiodide
CID 111839214
1,2-dimethyl-3-[2-(8-methylimidazo[1,2-a]pyridin-2-yl)ethyl]-1-pent-4-enylguanidine;hydroiodide
CID 109496303
N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-N',3-dimethylpiperidine-1-carboximidamide;hydroiodide
CID 119130101
N-[(8-methylimidazo[1,2-a]pyridin-2-yl)methyl]-3-(3-methylphenyl)piperidine-1-carboxamide
CID 119066687
1,2-dimethyl-3-[2-(8-methylimidazo[1,2-a]pyridin-2-yl)ethyl]-1-pent-4-enylguanidine
CID 109496304
(3R)-N-[(8-methylimidazo[1,2-a]pyridin-2-yl)methyl]-3-(3-methylphenyl)piperidine-1-carboxamide
CID 126438496
N-[2-(2-methoxy-5-methylphenyl)ethyl]-N',3-dimethylpiperidine-1-carboximidamide;hydroiodide
CID 111144681

Frequently Asked Questions

What is the IUPAC name of N',3-dimethyl-N-[2-(8-methylimidazo[1,2-a]pyridin-2-yl)ethyl]piperidine-1-carboximidamide;hydroiodide?
The IUPAC name of N',3-dimethyl-N-[2-(8-methylimidazo[1,2-a]pyridin-2-yl)ethyl]piperidine-1-carboximidamide;hydroiodide (CID 102559379) is N',3-dimethyl-N-[2-(8-methylimidazo[1,2-a]pyridin-2-yl)ethyl]piperidine-1-carboximidamide;hydroiodide.
What is the SMILES notation for N',3-dimethyl-N-[2-(8-methylimidazo[1,2-a]pyridin-2-yl)ethyl]piperidine-1-carboximidamide;hydroiodide?
The canonical SMILES for N',3-dimethyl-N-[2-(8-methylimidazo[1,2-a]pyridin-2-yl)ethyl]piperidine-1-carboximidamide;hydroiodide is C/N=C(/NCCc1cn2cccc(C)c2n1)N1CCCC(C)C1.I.
What is the InChIKey of N',3-dimethyl-N-[2-(8-methylimidazo[1,2-a]pyridin-2-yl)ethyl]piperidine-1-carboximidamide;hydroiodide?
The InChIKey is SGMDUFXFMNYZEM-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H27N5.HI/c1-14-6-4-11-23(12-14)18(19-3)20-9-8-16-13-22-10-5-7-15(2)17(22)21-16;/h5,7,10,13-14H,4,6,8-9,11-12H2,1-3H3,(H,19,20);1H.
What are the key properties of N',3-dimethyl-N-[2-(8-methylimidazo[1,2-a]pyridin-2-yl)ethyl]piperidine-1-carboximidamide;hydroiodide?
N',3-dimethyl-N-[2-(8-methylimidazo[1,2-a]pyridin-2-yl)ethyl]piperidine-1-carboximidamide;hydroiodide has a molecular weight of 441.36 g/mol, XLogP of 3.11, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N',3-dimethyl-N-[2-(8-methylimidazo[1,2-a]pyridin-2-yl)ethyl]piperidine-1-carboximidamide;hydroiodide is sourced from PubChem (CID 102559379), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).