N-amino-N',3-dimethylmorpholine-4-carboximidamide

C7H16N4O — CID 104882003

IUPACN-amino-N',3-dimethylmorpholine-4-carboximidamide
SMILESC/N=C(\NN)N1CCOCC1C
InChIInChI=1S/C7H16N4O/c1-6-5-12-4-3-11(6)7(9-2)10-8/h6H,3-5,8H2,1-2H3,(H,9,10)
InChIKeyIRMLMUJHRNVBKU-UHFFFAOYSA-N
MW172.23 g/mol
LogP-0.84
Rot. Bonds

About N-amino-N',3-dimethylmorpholine-4-carboximidamide

N-amino-N',3-dimethylmorpholine-4-carboximidamide (PubChem CID 104882003) has the molecular formula C7H16N4O and a molecular weight of 172.23 g/mol. Its IUPAC name is N-amino-N',3-dimethylmorpholine-4-carboximidamide.

Molecular Properties

Compound NameN-amino-N',3-dimethylmorpholine-4-carboximidamide
PubChem CID104882003
Molecular FormulaC7H16N4O
Molecular Weight172.23 g/mol
Exact Mass172.13
IUPAC NameN-amino-N',3-dimethylmorpholine-4-carboximidamide
SMILESC/N=C(\NN)N1CCOCC1C
InChIInChI=1S/C7H16N4O/c1-6-5-12-4-3-11(6)7(9-2)10-8/h6H,3-5,8H2,1-2H3,(H,9,10)
InChIKeyIRMLMUJHRNVBKU-UHFFFAOYSA-N
XLogP-0.84
TPSA62.88 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.23
LogP ≤ 5-0.84
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-N'-(1-methoxypropan-2-yl)-4-(2,2,2-trifluoroethyl)piperazine-1-carboximidamide
CID 104885928
N-amino-N'-methylmorpholine-4-carboximidamide
CID 22977260
1-Amino-2-(2-morpholin-4-ylpropyl)guanidine
CID 23126903
N'-propan-2-ylmorpholine-4-carboximidamide
CID 57837435
N-amino-N'-iodomorpholine-4-carboximidamide
CID 140077589
N'-methyl-N-(methylamino)morpholine-4-carboximidamide
CID 169236519
N-[amino-(2-methylhydrazinyl)methylidene]-N'-(methylideneamino)morpholine-4-carboximidamide
CID 174024845
N'-amino-3-methylmorpholine-4-carboximidamide
CID 45088548
N-amino-N'-methylmorpholine-4-carboximidamide;hydrochloride
CID 55281620
3-Methylmorpholine-4-carbohydrazonamide
CID 57358656
N'-ethyl-3-methylmorpholine-4-carboximidamide
CID 62363202
3-methyl-N'-propylmorpholine-4-carboximidamide
CID 62363203

Frequently Asked Questions

What is the IUPAC name of N-amino-N',3-dimethylmorpholine-4-carboximidamide?
The IUPAC name of N-amino-N',3-dimethylmorpholine-4-carboximidamide (CID 104882003) is N-amino-N',3-dimethylmorpholine-4-carboximidamide.
What is the SMILES notation for N-amino-N',3-dimethylmorpholine-4-carboximidamide?
The canonical SMILES for N-amino-N',3-dimethylmorpholine-4-carboximidamide is C/N=C(\NN)N1CCOCC1C.
What is the InChIKey of N-amino-N',3-dimethylmorpholine-4-carboximidamide?
The InChIKey is IRMLMUJHRNVBKU-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H16N4O/c1-6-5-12-4-3-11(6)7(9-2)10-8/h6H,3-5,8H2,1-2H3,(H,9,10).
What are the key properties of N-amino-N',3-dimethylmorpholine-4-carboximidamide?
N-amino-N',3-dimethylmorpholine-4-carboximidamide has a molecular weight of 172.23 g/mol, XLogP of -0.84, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-amino-N',3-dimethylmorpholine-4-carboximidamide is sourced from PubChem (CID 104882003), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).