1-(imidazo[1,2-a]pyridin-2-ylmethyl)-2-methyl-3-[(2-methylpyrazol-3-yl)methyl]guanidine

C15H19N7 — CID 119151641

IUPAC1-(imidazo[1,2-a]pyridin-2-ylmethyl)-2-methyl-3-[(2-methylpyrazol-3-yl)methyl]guanidine
SMILESC/N=C(/NCc1cn2ccccc2n1)NCc1ccnn1C
InChIInChI=1S/C15H19N7/c1-16-15(18-10-13-6-7-19-21(13)2)17-9-12-11-22-8-4-3-5-14(22)20-12/h3-8,11H,9-10H2,1-2H3,(H2,16,17,18)
InChIKeyJXHUYXSMERZOJY-UHFFFAOYSA-N
MW297.37 g/mol
LogP0.93
Rot. Bonds4

About 1-(imidazo[1,2-a]pyridin-2-ylmethyl)-2-methyl-3-[(2-methylpyrazol-3-yl)methyl]guanidine

1-(imidazo[1,2-a]pyridin-2-ylmethyl)-2-methyl-3-[(2-methylpyrazol-3-yl)methyl]guanidine (PubChem CID 119151641) has the molecular formula C15H19N7 and a molecular weight of 297.37 g/mol. Its IUPAC name is 1-(imidazo[1,2-a]pyridin-2-ylmethyl)-2-methyl-3-[(2-methylpyrazol-3-yl)methyl]guanidine.

Molecular Properties

Compound Name1-(imidazo[1,2-a]pyridin-2-ylmethyl)-2-methyl-3-[(2-methylpyrazol-3-yl)methyl]guanidine
PubChem CID119151641
Molecular FormulaC15H19N7
Molecular Weight297.37 g/mol
Exact Mass297.17
IUPAC Name1-(imidazo[1,2-a]pyridin-2-ylmethyl)-2-methyl-3-[(2-methylpyrazol-3-yl)methyl]guanidine
SMILESC/N=C(/NCc1cn2ccccc2n1)NCc1ccnn1C
InChIInChI=1S/C15H19N7/c1-16-15(18-10-13-6-7-19-21(13)2)17-9-12-11-22-8-4-3-5-14(22)20-12/h3-8,11H,9-10H2,1-2H3,(H2,16,17,18)
InChIKeyJXHUYXSMERZOJY-UHFFFAOYSA-N
XLogP0.93
TPSA71.54 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.37
LogP ≤ 50.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

1-tert-butyl-3-(imidazo[1,2-a]pyridin-2-ylmethyl)-2-methylguanidine
CID 119116119
1-(imidazo[1,2-a]pyridin-2-ylmethyl)-2-methyl-3-[(4-methyl-1,3-thiazol-2-yl)methyl]guanidine
CID 119116994
1-(imidazo[1,2-a]pyridin-2-ylmethyl)-2-methyl-3-[(4-methyl-1,3-thiazol-2-yl)methyl]guanidine;hydroiodide
CID 119116993
1-(imidazo[1,2-a]pyridin-2-ylmethyl)-2-methylguanidine
CID 110913540
2-methyl-1-[(2-methylpyrazol-3-yl)methyl]-3-[(5-phenyl-1,2-oxazol-3-yl)methyl]guanidine
CID 111956077
1-benzyl-3-(2-imidazo[1,2-a]pyridin-2-ylethyl)-2-methylguanidine;hydroiodide
CID 110954059
2-methyl-1-[(2-methylpyrazol-3-yl)methyl]-3-propylguanidine
CID 111226466
1-(imidazo[1,2-a]pyridin-2-ylmethyl)-3-[1-(2-methoxyphenyl)ethyl]-2-methylguanidine;hydroiodide
CID 119131733
1-[[2-(methoxymethyl)phenyl]methyl]-2-methyl-3-[(2-methylpyrazol-3-yl)methyl]guanidine
CID 111954415
1-[(4-fluorophenyl)methyl]-3-(2-imidazo[1,2-a]pyridin-2-ylethyl)-2-methylguanidine
CID 111232571
1-[(5-ethyl-1,3-thiazol-2-yl)methyl]-3-(2-imidazo[1,2-a]pyridin-2-ylethyl)-2-methylguanidine
CID 111535580
1-(2-imidazo[1,2-a]pyridin-2-ylethyl)-2,3-dimethylguanidine
CID 99845838

Frequently Asked Questions

What is the IUPAC name of 1-(imidazo[1,2-a]pyridin-2-ylmethyl)-2-methyl-3-[(2-methylpyrazol-3-yl)methyl]guanidine?
The IUPAC name of 1-(imidazo[1,2-a]pyridin-2-ylmethyl)-2-methyl-3-[(2-methylpyrazol-3-yl)methyl]guanidine (CID 119151641) is 1-(imidazo[1,2-a]pyridin-2-ylmethyl)-2-methyl-3-[(2-methylpyrazol-3-yl)methyl]guanidine.
What is the SMILES notation for 1-(imidazo[1,2-a]pyridin-2-ylmethyl)-2-methyl-3-[(2-methylpyrazol-3-yl)methyl]guanidine?
The canonical SMILES for 1-(imidazo[1,2-a]pyridin-2-ylmethyl)-2-methyl-3-[(2-methylpyrazol-3-yl)methyl]guanidine is C/N=C(/NCc1cn2ccccc2n1)NCc1ccnn1C.
What is the InChIKey of 1-(imidazo[1,2-a]pyridin-2-ylmethyl)-2-methyl-3-[(2-methylpyrazol-3-yl)methyl]guanidine?
The InChIKey is JXHUYXSMERZOJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N7/c1-16-15(18-10-13-6-7-19-21(13)2)17-9-12-11-22-8-4-3-5-14(22)20-12/h3-8,11H,9-10H2,1-2H3,(H2,16,17,18).
What are the key properties of 1-(imidazo[1,2-a]pyridin-2-ylmethyl)-2-methyl-3-[(2-methylpyrazol-3-yl)methyl]guanidine?
1-(imidazo[1,2-a]pyridin-2-ylmethyl)-2-methyl-3-[(2-methylpyrazol-3-yl)methyl]guanidine has a molecular weight of 297.37 g/mol, XLogP of 0.93, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(imidazo[1,2-a]pyridin-2-ylmethyl)-2-methyl-3-[(2-methylpyrazol-3-yl)methyl]guanidine is sourced from PubChem (CID 119151641), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).