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

C7H17N5O — CID 15114686

IUPAC1-amino-2-(2-morpholin-4-ylethyl)guanidine
SMILESNN/C(N)=N/CCN1CCOCC1
InChIInChI=1S/C7H17N5O/c8-7(11-9)10-1-2-12-3-5-13-6-4-12/h1-6,9H2,(H3,8,10,11)
InChIKeyQUPVVNCVKMEUKU-UHFFFAOYSA-N
MW187.25 g/mol
LogP-1.90
Rot. Bonds3

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

1-amino-2-(2-morpholin-4-ylethyl)guanidine (PubChem CID 15114686) has the molecular formula C7H17N5O and a molecular weight of 187.25 g/mol. Its IUPAC name is 1-amino-2-(2-morpholin-4-ylethyl)guanidine.

Molecular Properties

Compound Name1-amino-2-(2-morpholin-4-ylethyl)guanidine
PubChem CID15114686
Molecular FormulaC7H17N5O
Molecular Weight187.25 g/mol
Exact Mass187.14
IUPAC Name1-amino-2-(2-morpholin-4-ylethyl)guanidine
SMILESNN/C(N)=N/CCN1CCOCC1
InChIInChI=1S/C7H17N5O/c8-7(11-9)10-1-2-12-3-5-13-6-4-12/h1-6,9H2,(H3,8,10,11)
InChIKeyQUPVVNCVKMEUKU-UHFFFAOYSA-N
XLogP-1.90
TPSA88.90 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.25
LogP ≤ 5-1.90
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

1,2-bis(2-morpholin-4-ylethyl)guanidine
CID 141003386
1-amino-2-[3-[4-[3-[[amino(hydrazinyl)methylidene]amino]propyl]piperazin-1-yl]propyl]guanidine
CID 15052354
2-(2-morpholin-4-ylethyl)-1-phenylguanidine
CID 62364486
N-hydroxy-N'-(2-morpholin-4-ylethyl)ethanimidamide
CID 54363769
1-[2-(azepan-1-yl)ethyl]-2-(3-morpholin-4-ylpropyl)guanidine;hydroiodide
CID 111057007
1-(4-morpholin-4-ylbutyl)-2-propylguanidine;hydroiodide
CID 111059844
2-(2-morpholin-4-ylethyl)-1-pyridin-2-ylguanidine;hydroiodide
CID 119117134
1-(4-methylpentyl)-2-(3-morpholin-4-ylpropyl)guanidine
CID 111054905
N'-(2-morpholin-4-ylethyl)thiomorpholine-4-carboximidamide;hydroiodide
CID 111024484
2-chloro-N'-(3-morpholin-4-ylpropyl)ethanimidamide;hydrochloride
CID 54610602
1-amino-3-(1-methoxypropan-2-yl)-2-(2-morpholin-4-ylethyl)guanidine
CID 104883090
2-(2-morpholin-4-ylethyl)-1-(4-propan-2-yloxyphenyl)guanidine
CID 111024489

Frequently Asked Questions

What is the IUPAC name of 1-amino-2-(2-morpholin-4-ylethyl)guanidine?
The IUPAC name of 1-amino-2-(2-morpholin-4-ylethyl)guanidine (CID 15114686) is 1-amino-2-(2-morpholin-4-ylethyl)guanidine.
What is the SMILES notation for 1-amino-2-(2-morpholin-4-ylethyl)guanidine?
The canonical SMILES for 1-amino-2-(2-morpholin-4-ylethyl)guanidine is NN/C(N)=N/CCN1CCOCC1.
What is the InChIKey of 1-amino-2-(2-morpholin-4-ylethyl)guanidine?
The InChIKey is QUPVVNCVKMEUKU-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H17N5O/c8-7(11-9)10-1-2-12-3-5-13-6-4-12/h1-6,9H2,(H3,8,10,11).
What are the key properties of 1-amino-2-(2-morpholin-4-ylethyl)guanidine?
1-amino-2-(2-morpholin-4-ylethyl)guanidine has a molecular weight of 187.25 g/mol, XLogP of -1.90, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-2-(2-morpholin-4-ylethyl)guanidine is sourced from PubChem (CID 15114686), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).