2-(2-morpholin-4-ylethyl)-1-pyridin-2-ylguanidine;hydroiodide

C12H20IN5O — CID 119117134

IUPAC2-(2-morpholin-4-ylethyl)-1-pyridin-2-ylguanidine;hydroiodide
SMILESI.N/C(=N\CCN1CCOCC1)Nc1ccccn1
InChIInChI=1S/C12H19N5O.HI/c13-12(16-11-3-1-2-4-14-11)15-5-6-17-7-9-18-10-8-17;/h1-4H,5-10H2,(H3,13,14,15,16);1H
InChIKeyLXCCIBVZJGONPD-UHFFFAOYSA-N
MW377.23 g/mol
LogP0.76
Rot. Bonds4

About 2-(2-morpholin-4-ylethyl)-1-pyridin-2-ylguanidine;hydroiodide

2-(2-morpholin-4-ylethyl)-1-pyridin-2-ylguanidine;hydroiodide (PubChem CID 119117134) has the molecular formula C12H20IN5O and a molecular weight of 377.23 g/mol. Its IUPAC name is 2-(2-morpholin-4-ylethyl)-1-pyridin-2-ylguanidine;hydroiodide.

Molecular Properties

Compound Name2-(2-morpholin-4-ylethyl)-1-pyridin-2-ylguanidine;hydroiodide
PubChem CID119117134
Molecular FormulaC12H20IN5O
Molecular Weight377.23 g/mol
Exact Mass377.07
IUPAC Name2-(2-morpholin-4-ylethyl)-1-pyridin-2-ylguanidine;hydroiodide
SMILESI.N/C(=N\CCN1CCOCC1)Nc1ccccn1
InChIInChI=1S/C12H19N5O.HI/c13-12(16-11-3-1-2-4-14-11)15-5-6-17-7-9-18-10-8-17;/h1-4H,5-10H2,(H3,13,14,15,16);1H
InChIKeyLXCCIBVZJGONPD-UHFFFAOYSA-N
XLogP0.76
TPSA75.77 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500377.23
LogP ≤ 50.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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

2-[2-(2,2-dimethylmorpholin-4-yl)ethyl]-1-pyridin-2-ylguanidine;hydroiodide
CID 119120862
2-[2-(3,6-dihydro-2H-pyridin-1-yl)ethyl]-1-pyridin-2-ylguanidine;hydroiodide
CID 120662941
2-(2-morpholin-4-ylethyl)-1-phenylguanidine
CID 62364486
2-[(1-morpholin-4-ylcyclopropyl)methyl]-1-pyridin-2-ylguanidine;hydroiodide
CID 120558132
2-[2-(1,1-dioxo-1,2-thiazolidin-2-yl)ethyl]-1-pyridin-2-ylguanidine
CID 119121081
2-(4-morpholin-4-ylbutyl)-1-(2-pyridin-2-ylethyl)guanidine
CID 111059887
2-[2-(1-methylpyrazol-4-yl)ethyl]-1-pyridin-2-ylguanidine;hydroiodide
CID 119119227
2-[(4-benzylmorpholin-2-yl)methyl]-1-pyridin-2-ylguanidine
CID 119117265
2-[2-(3-fluorophenyl)-2-morpholin-4-ylethyl]-1-pyridin-2-ylguanidine;hydroiodide
CID 119120609
2-[(5-chloro-2-morpholin-4-ylphenyl)methyl]-1-pyridin-2-ylguanidine
CID 120679682
2-[(5-morpholin-4-ylsulfonylthiophen-2-yl)methyl]-1-pyridin-2-ylguanidine
CID 119118993
1-amino-2-(2-morpholin-4-ylethyl)guanidine
CID 15114686

Frequently Asked Questions

What is the IUPAC name of 2-(2-morpholin-4-ylethyl)-1-pyridin-2-ylguanidine;hydroiodide?
The IUPAC name of 2-(2-morpholin-4-ylethyl)-1-pyridin-2-ylguanidine;hydroiodide (CID 119117134) is 2-(2-morpholin-4-ylethyl)-1-pyridin-2-ylguanidine;hydroiodide.
What is the SMILES notation for 2-(2-morpholin-4-ylethyl)-1-pyridin-2-ylguanidine;hydroiodide?
The canonical SMILES for 2-(2-morpholin-4-ylethyl)-1-pyridin-2-ylguanidine;hydroiodide is I.N/C(=N\CCN1CCOCC1)Nc1ccccn1.
What is the InChIKey of 2-(2-morpholin-4-ylethyl)-1-pyridin-2-ylguanidine;hydroiodide?
The InChIKey is LXCCIBVZJGONPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N5O.HI/c13-12(16-11-3-1-2-4-14-11)15-5-6-17-7-9-18-10-8-17;/h1-4H,5-10H2,(H3,13,14,15,16);1H.
What are the key properties of 2-(2-morpholin-4-ylethyl)-1-pyridin-2-ylguanidine;hydroiodide?
2-(2-morpholin-4-ylethyl)-1-pyridin-2-ylguanidine;hydroiodide has a molecular weight of 377.23 g/mol, XLogP of 0.76, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-morpholin-4-ylethyl)-1-pyridin-2-ylguanidine;hydroiodide is sourced from PubChem (CID 119117134), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).