N'-(imidazo[1,2-a]pyridin-2-ylmethyl)morpholine-4-carboximidamide

C13H17N5O — CID 111031170

IUPACN'-(imidazo[1,2-a]pyridin-2-ylmethyl)morpholine-4-carboximidamide
SMILESN/C(=N\Cc1cn2ccccc2n1)N1CCOCC1
InChIInChI=1S/C13H17N5O/c14-13(17-5-7-19-8-6-17)15-9-11-10-18-4-2-1-3-12(18)16-11/h1-4,10H,5-9H2,(H2,14,15)
InChIKeyFNWRBGXQVHGWBE-UHFFFAOYSA-N
MW259.31 g/mol
LogP0.48
Rot. Bonds2

About N'-(imidazo[1,2-a]pyridin-2-ylmethyl)morpholine-4-carboximidamide

N'-(imidazo[1,2-a]pyridin-2-ylmethyl)morpholine-4-carboximidamide (PubChem CID 111031170) has the molecular formula C13H17N5O and a molecular weight of 259.31 g/mol. Its IUPAC name is N'-(imidazo[1,2-a]pyridin-2-ylmethyl)morpholine-4-carboximidamide.

Molecular Properties

Compound NameN'-(imidazo[1,2-a]pyridin-2-ylmethyl)morpholine-4-carboximidamide
PubChem CID111031170
Molecular FormulaC13H17N5O
Molecular Weight259.31 g/mol
Exact Mass259.14
IUPAC NameN'-(imidazo[1,2-a]pyridin-2-ylmethyl)morpholine-4-carboximidamide
SMILESN/C(=N\Cc1cn2ccccc2n1)N1CCOCC1
InChIInChI=1S/C13H17N5O/c14-13(17-5-7-19-8-6-17)15-9-11-10-18-4-2-1-3-12(18)16-11/h1-4,10H,5-9H2,(H2,14,15)
InChIKeyFNWRBGXQVHGWBE-UHFFFAOYSA-N
XLogP0.48
TPSA68.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.31
LogP ≤ 50.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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

N'-([1,2,4]triazolo[4,3-a]pyridin-3-ylmethyl)morpholine-4-carboximidamide;hydroiodide
CID 111031625
1-cyclopropyl-2-(imidazo[1,2-a]pyridin-2-ylmethyl)-1-methylguanidine
CID 110029530
1-butan-2-yl-2-(imidazo[1,2-a]pyridin-2-ylmethyl)guanidine
CID 110919308
N'-[(2-methylpyrimidin-4-yl)methyl]morpholine-4-carboximidamide;hydroiodide
CID 119119928
N'-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-ylmethyl)morpholine-4-carboximidamide;hydroiodide
CID 119121254
N'-[(7-methylimidazo[1,2-a]pyridin-2-yl)methyl]thiomorpholine-4-carboximidamide
CID 119119846
[(3S,4S)-1-(imidazo[1,2-a]pyridin-2-ylmethyl)-4-methylpyrrolidin-3-yl]-morpholin-4-ylmethanone
CID 154793507
N'-[[2-(hydroxymethyl)phenyl]methyl]morpholine-4-carboximidamide;hydroiodide
CID 111077296
N'-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-2-methylmorpholine-4-carboximidamide;hydroiodide
CID 120661163
N'-[(1-methylpyrrol-2-yl)methyl]morpholine-4-carboximidamide;hydroiodide
CID 119146669
N'-[[2-(dimethylamino)-1,3-thiazol-4-yl]methyl]morpholine-4-carboximidamide
CID 111600825
1-(2-imidazo[1,2-a]pyridin-2-ylethyl)-2-methyl-3-(2-morpholin-4-ylethyl)guanidine
CID 111040218

Frequently Asked Questions

What is the IUPAC name of N'-(imidazo[1,2-a]pyridin-2-ylmethyl)morpholine-4-carboximidamide?
The IUPAC name of N'-(imidazo[1,2-a]pyridin-2-ylmethyl)morpholine-4-carboximidamide (CID 111031170) is N'-(imidazo[1,2-a]pyridin-2-ylmethyl)morpholine-4-carboximidamide.
What is the SMILES notation for N'-(imidazo[1,2-a]pyridin-2-ylmethyl)morpholine-4-carboximidamide?
The canonical SMILES for N'-(imidazo[1,2-a]pyridin-2-ylmethyl)morpholine-4-carboximidamide is N/C(=N\Cc1cn2ccccc2n1)N1CCOCC1.
What is the InChIKey of N'-(imidazo[1,2-a]pyridin-2-ylmethyl)morpholine-4-carboximidamide?
The InChIKey is FNWRBGXQVHGWBE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17N5O/c14-13(17-5-7-19-8-6-17)15-9-11-10-18-4-2-1-3-12(18)16-11/h1-4,10H,5-9H2,(H2,14,15).
What are the key properties of N'-(imidazo[1,2-a]pyridin-2-ylmethyl)morpholine-4-carboximidamide?
N'-(imidazo[1,2-a]pyridin-2-ylmethyl)morpholine-4-carboximidamide has a molecular weight of 259.31 g/mol, XLogP of 0.48, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(imidazo[1,2-a]pyridin-2-ylmethyl)morpholine-4-carboximidamide is sourced from PubChem (CID 111031170), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).