N-amino-2-ethyl-N'-(2-methylpropyl)morpholine-4-carboximidamide

C11H24N4O — CID 104883908

IUPACN-amino-2-ethyl-N'-(2-methylpropyl)morpholine-4-carboximidamide
SMILESCCC1CN(/C(=N/CC(C)C)NN)CCO1
InChIInChI=1S/C11H24N4O/c1-4-10-8-15(5-6-16-10)11(14-12)13-7-9(2)3/h9-10H,4-8,12H2,1-3H3,(H,13,14)
InChIKeyUDGRMWMIWWFPFC-UHFFFAOYSA-N
MW228.34 g/mol
LogP0.57
Rot. Bonds3

About N-amino-2-ethyl-N'-(2-methylpropyl)morpholine-4-carboximidamide

N-amino-2-ethyl-N'-(2-methylpropyl)morpholine-4-carboximidamide (PubChem CID 104883908) has the molecular formula C11H24N4O and a molecular weight of 228.34 g/mol. Its IUPAC name is N-amino-2-ethyl-N'-(2-methylpropyl)morpholine-4-carboximidamide.

Molecular Properties

Compound NameN-amino-2-ethyl-N'-(2-methylpropyl)morpholine-4-carboximidamide
PubChem CID104883908
Molecular FormulaC11H24N4O
Molecular Weight228.34 g/mol
Exact Mass228.20
IUPAC NameN-amino-2-ethyl-N'-(2-methylpropyl)morpholine-4-carboximidamide
SMILESCCC1CN(/C(=N/CC(C)C)NN)CCO1
InChIInChI=1S/C11H24N4O/c1-4-10-8-15(5-6-16-10)11(14-12)13-7-9(2)3/h9-10H,4-8,12H2,1-3H3,(H,13,14)
InChIKeyUDGRMWMIWWFPFC-UHFFFAOYSA-N
XLogP0.57
TPSA62.88 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.34
LogP ≤ 50.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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

N-amino-4-tert-butyl-N'-(2-methylpropyl)piperidine-1-carboximidamide
CID 104884230
N-amino-4-tert-butyl-N'-(2-methylpropyl)piperazine-1-carboximidamide
CID 104885333
N-amino-3,3-dimethyl-N'-(2-methylpropyl)piperidine-1-carboximidamide
CID 104886315
N-(2-aminoethyl)-2-ethylmorpholine-4-carboxamide
CID 82506232
N-amino-N'-cyclopropyl-2-(hydroxymethyl)morpholine-4-carboximidamide
CID 104887680
2-ethylmorpholine-4-carboxylic acid
CID 121455686
3-(2-ethylmorpholin-4-yl)-2-methylbutanehydrazide
CID 79408999
N-amino-N'-(2-methylpropyl)-1,4-thiazepane-4-carboximidamide
CID 104885614
N-amino-3,3,4-trimethyl-N'-(2-methylpropyl)piperazine-1-carboximidamide
CID 104886298
(2R)-1-[(2S)-2-ethylmorpholin-4-yl]-2-methylsulfonylpropan-1-one
CID 95153981
3-[cyclopropyl-(2-ethylmorpholine-4-carbonyl)amino]propanoic acid
CID 61202092
1-[(2R)-2-ethylmorpholin-4-yl]-2,2-dimethylpropan-1-one
CID 166684101

Frequently Asked Questions

What is the IUPAC name of N-amino-2-ethyl-N'-(2-methylpropyl)morpholine-4-carboximidamide?
The IUPAC name of N-amino-2-ethyl-N'-(2-methylpropyl)morpholine-4-carboximidamide (CID 104883908) is N-amino-2-ethyl-N'-(2-methylpropyl)morpholine-4-carboximidamide.
What is the SMILES notation for N-amino-2-ethyl-N'-(2-methylpropyl)morpholine-4-carboximidamide?
The canonical SMILES for N-amino-2-ethyl-N'-(2-methylpropyl)morpholine-4-carboximidamide is CCC1CN(/C(=N/CC(C)C)NN)CCO1.
What is the InChIKey of N-amino-2-ethyl-N'-(2-methylpropyl)morpholine-4-carboximidamide?
The InChIKey is UDGRMWMIWWFPFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N4O/c1-4-10-8-15(5-6-16-10)11(14-12)13-7-9(2)3/h9-10H,4-8,12H2,1-3H3,(H,13,14).
What are the key properties of N-amino-2-ethyl-N'-(2-methylpropyl)morpholine-4-carboximidamide?
N-amino-2-ethyl-N'-(2-methylpropyl)morpholine-4-carboximidamide has a molecular weight of 228.34 g/mol, XLogP of 0.57, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-amino-2-ethyl-N'-(2-methylpropyl)morpholine-4-carboximidamide is sourced from PubChem (CID 104883908), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).