N-amino-N'-cyclopropyl-2,2,6,6-tetramethylmorpholine-4-carboximidamide

C12H24N4O — CID 102746790

IUPACN-amino-N'-cyclopropyl-2,2,6,6-tetramethylmorpholine-4-carboximidamide
SMILESCC1(C)CN(/C(=N/C2CC2)NN)CC(C)(C)O1
InChIInChI=1S/C12H24N4O/c1-11(2)7-16(8-12(3,4)17-11)10(15-13)14-9-5-6-9/h9H,5-8,13H2,1-4H3,(H,14,15)
InChIKeyRBSRCDIINUGJNX-UHFFFAOYSA-N
MW240.35 g/mol
LogP0.86
Rot. Bonds1

About N-amino-N'-cyclopropyl-2,2,6,6-tetramethylmorpholine-4-carboximidamide

N-amino-N'-cyclopropyl-2,2,6,6-tetramethylmorpholine-4-carboximidamide (PubChem CID 102746790) has the molecular formula C12H24N4O and a molecular weight of 240.35 g/mol. Its IUPAC name is N-amino-N'-cyclopropyl-2,2,6,6-tetramethylmorpholine-4-carboximidamide.

Molecular Properties

Compound NameN-amino-N'-cyclopropyl-2,2,6,6-tetramethylmorpholine-4-carboximidamide
PubChem CID102746790
Molecular FormulaC12H24N4O
Molecular Weight240.35 g/mol
Exact Mass240.20
IUPAC NameN-amino-N'-cyclopropyl-2,2,6,6-tetramethylmorpholine-4-carboximidamide
SMILESCC1(C)CN(/C(=N/C2CC2)NN)CC(C)(C)O1
InChIInChI=1S/C12H24N4O/c1-11(2)7-16(8-12(3,4)17-11)10(15-13)14-9-5-6-9/h9H,5-8,13H2,1-4H3,(H,14,15)
InChIKeyRBSRCDIINUGJNX-UHFFFAOYSA-N
XLogP0.86
TPSA62.88 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.35
LogP ≤ 50.86
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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Frequently Asked Questions

What is the IUPAC name of N-amino-N'-cyclopropyl-2,2,6,6-tetramethylmorpholine-4-carboximidamide?
The IUPAC name of N-amino-N'-cyclopropyl-2,2,6,6-tetramethylmorpholine-4-carboximidamide (CID 102746790) is N-amino-N'-cyclopropyl-2,2,6,6-tetramethylmorpholine-4-carboximidamide.
What is the SMILES notation for N-amino-N'-cyclopropyl-2,2,6,6-tetramethylmorpholine-4-carboximidamide?
The canonical SMILES for N-amino-N'-cyclopropyl-2,2,6,6-tetramethylmorpholine-4-carboximidamide is CC1(C)CN(/C(=N/C2CC2)NN)CC(C)(C)O1.
What is the InChIKey of N-amino-N'-cyclopropyl-2,2,6,6-tetramethylmorpholine-4-carboximidamide?
The InChIKey is RBSRCDIINUGJNX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N4O/c1-11(2)7-16(8-12(3,4)17-11)10(15-13)14-9-5-6-9/h9H,5-8,13H2,1-4H3,(H,14,15).
What are the key properties of N-amino-N'-cyclopropyl-2,2,6,6-tetramethylmorpholine-4-carboximidamide?
N-amino-N'-cyclopropyl-2,2,6,6-tetramethylmorpholine-4-carboximidamide has a molecular weight of 240.35 g/mol, XLogP of 0.86, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-amino-N'-cyclopropyl-2,2,6,6-tetramethylmorpholine-4-carboximidamide is sourced from PubChem (CID 102746790), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).