N,N-dimethylmorpholine-4-carboximidamide;ethane

C9H21N3O — CID 145053354

IUPACN,N-dimethylmorpholine-4-carboximidamide;ethane
SMILESCC.[H]/N=C(\N(C)C)N1CCOCC1
InChIInChI=1S/C7H15N3O.C2H6/c1-9(2)7(8)10-3-5-11-6-4-10;1-2/h8H,3-6H2,1-2H3;1-2H3/b8-7+;
InChIKeyBAPTVFKIOKYMFE-USRGLUTNSA-N
MW187.29 g/mol
LogP0.84
Rot. Bonds

About N,N-dimethylmorpholine-4-carboximidamide;ethane

N,N-dimethylmorpholine-4-carboximidamide;ethane (PubChem CID 145053354) has the molecular formula C9H21N3O and a molecular weight of 187.29 g/mol. Its IUPAC name is N,N-dimethylmorpholine-4-carboximidamide;ethane.

Molecular Properties

Compound NameN,N-dimethylmorpholine-4-carboximidamide;ethane
PubChem CID145053354
Molecular FormulaC9H21N3O
Molecular Weight187.29 g/mol
Exact Mass187.17
IUPAC NameN,N-dimethylmorpholine-4-carboximidamide;ethane
SMILESCC.[H]/N=C(\N(C)C)N1CCOCC1
InChIInChI=1S/C7H15N3O.C2H6/c1-9(2)7(8)10-3-5-11-6-4-10;1-2/h8H,3-6H2,1-2H3;1-2H3/b8-7+;
InChIKeyBAPTVFKIOKYMFE-USRGLUTNSA-N
XLogP0.84
TPSA39.56 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.29
LogP ≤ 50.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

Analyze N,N-dimethylmorpholine-4-carboximidamide;ethane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

Moroxydine
CID 71655
Morpholine-4-carboximidamide Hydroiodide
CID 2778396
N'-carbamimidoylmorpholine-4-carboximidamide
CID 137345967
Morpholinoamidine
CID 205053
Morpholine-4-carboximidamide Hydrobromide
CID 2806564
Morpholine-4-carboximidamide hydrochloride
CID 12427952
2,6-dimethylmorpholine-4-carboximidamide Hydrobromide
CID 2806562
N'-carbamimidoylmorpholine-4-carboximidamide
CID 135742562
2,6-Dimethylmorpholine-4-carboximidamide
CID 2806563
2-Methylmorpholine-4-carboximidamide
CID 12011845
3-Methylmorpholine-4-carboximidamide
CID 12011846
Dimorpholin-4-ylmethanimine
CID 12240609

Frequently Asked Questions

What is the IUPAC name of N,N-dimethylmorpholine-4-carboximidamide;ethane?
The IUPAC name of N,N-dimethylmorpholine-4-carboximidamide;ethane (CID 145053354) is N,N-dimethylmorpholine-4-carboximidamide;ethane.
What is the SMILES notation for N,N-dimethylmorpholine-4-carboximidamide;ethane?
The canonical SMILES for N,N-dimethylmorpholine-4-carboximidamide;ethane is CC.[H]/N=C(\N(C)C)N1CCOCC1.
What is the InChIKey of N,N-dimethylmorpholine-4-carboximidamide;ethane?
The InChIKey is BAPTVFKIOKYMFE-USRGLUTNSA-N. The full InChI is InChI=1S/C7H15N3O.C2H6/c1-9(2)7(8)10-3-5-11-6-4-10;1-2/h8H,3-6H2,1-2H3;1-2H3/b8-7+;.
What are the key properties of N,N-dimethylmorpholine-4-carboximidamide;ethane?
N,N-dimethylmorpholine-4-carboximidamide;ethane has a molecular weight of 187.29 g/mol, XLogP of 0.84, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethylmorpholine-4-carboximidamide;ethane is sourced from PubChem (CID 145053354), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).