1-amino-2-methyl-3-(2-morpholin-4-ylethyl)guanidine

C8H19N5O — CID 104881945

IUPAC1-amino-2-methyl-3-(2-morpholin-4-ylethyl)guanidine
SMILESC/N=C(\NN)NCCN1CCOCC1
InChIInChI=1S/C8H19N5O/c1-10-8(12-9)11-2-3-13-4-6-14-7-5-13/h2-7,9H2,1H3,(H2,10,11,12)
InChIKeyGIQBAIZUZWOFIF-UHFFFAOYSA-N
MW201.27 g/mol
LogP-1.64
Rot. Bonds3

About 1-amino-2-methyl-3-(2-morpholin-4-ylethyl)guanidine

1-amino-2-methyl-3-(2-morpholin-4-ylethyl)guanidine (PubChem CID 104881945) has the molecular formula C8H19N5O and a molecular weight of 201.27 g/mol. Its IUPAC name is 1-amino-2-methyl-3-(2-morpholin-4-ylethyl)guanidine.

Molecular Properties

Compound Name1-amino-2-methyl-3-(2-morpholin-4-ylethyl)guanidine
PubChem CID104881945
Molecular FormulaC8H19N5O
Molecular Weight201.27 g/mol
Exact Mass201.16
IUPAC Name1-amino-2-methyl-3-(2-morpholin-4-ylethyl)guanidine
SMILESC/N=C(\NN)NCCN1CCOCC1
InChIInChI=1S/C8H19N5O/c1-10-8(12-9)11-2-3-13-4-6-14-7-5-13/h2-7,9H2,1H3,(H2,10,11,12)
InChIKeyGIQBAIZUZWOFIF-UHFFFAOYSA-N
XLogP-1.64
TPSA74.91 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.27
LogP ≤ 5-1.64
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

2-N-(3-morpholin-4-ylpropyl)-4,5-dihydroimidazole-1,2-diamine
CID 19785377
2-[4-(2-Aminoethyl)morpholin-4-ium-4-yl]-4,5-dihydroimidazol-1-amine
CID 19785393
2-N-(2-morpholin-4-ylethyl)-4,5-dihydroimidazole-1,2-diamine
CID 19785414
N-amino-N'-methylmorpholine-4-carboximidamide
CID 22977260
2-Methyl-1-(2-morpholin-4-ylethyl)guanidine
CID 62359523
1-N-iodo-2-N-(2-morpholin-4-ylethyl)-4,5-dihydroimidazole-1,2-diamine
CID 87858430
N'-methyl-N-(methylamino)morpholine-4-carboximidamide
CID 169236519
N-[amino-(2-methylhydrazinyl)methylidene]-N'-(methylideneamino)morpholine-4-carboximidamide
CID 174024845
N-(4,5-dihydro-1H-imidazol-2-yl)morpholin-4-amine
CID 15890949
N-(4,5-dihydro-1H-imidazol-2-yl)morpholin-4-amine;hydroiodide
CID 44236293
1-Ethyl-2-(2-morpholin-4-ylethyl)guanidine
CID 62361956
1-(2-Morpholin-4-ylethyl)-2-propylguanidine
CID 62361957

Frequently Asked Questions

What is the IUPAC name of 1-amino-2-methyl-3-(2-morpholin-4-ylethyl)guanidine?
The IUPAC name of 1-amino-2-methyl-3-(2-morpholin-4-ylethyl)guanidine (CID 104881945) is 1-amino-2-methyl-3-(2-morpholin-4-ylethyl)guanidine.
What is the SMILES notation for 1-amino-2-methyl-3-(2-morpholin-4-ylethyl)guanidine?
The canonical SMILES for 1-amino-2-methyl-3-(2-morpholin-4-ylethyl)guanidine is C/N=C(\NN)NCCN1CCOCC1.
What is the InChIKey of 1-amino-2-methyl-3-(2-morpholin-4-ylethyl)guanidine?
The InChIKey is GIQBAIZUZWOFIF-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H19N5O/c1-10-8(12-9)11-2-3-13-4-6-14-7-5-13/h2-7,9H2,1H3,(H2,10,11,12).
What are the key properties of 1-amino-2-methyl-3-(2-morpholin-4-ylethyl)guanidine?
1-amino-2-methyl-3-(2-morpholin-4-ylethyl)guanidine has a molecular weight of 201.27 g/mol, XLogP of -1.64, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-2-methyl-3-(2-morpholin-4-ylethyl)guanidine is sourced from PubChem (CID 104881945), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).