3-(2,2,6,6-tetramethylmorpholin-4-yl)propanimidamide

C11H23N3O — CID 102744123

IUPAC3-(2,2,6,6-tetramethylmorpholin-4-yl)propanimidamide
SMILES[H]/N=C(\N)CCN1CC(C)(C)OC(C)(C)C1
InChIInChI=1S/C11H23N3O/c1-10(2)7-14(6-5-9(12)13)8-11(3,4)15-10/h5-8H2,1-4H3,(H3,12,13)
InChIKeyGZHMCOVZLCCWFD-UHFFFAOYSA-N
MW213.32 g/mol
LogP1.20
Rot. Bonds3

About 3-(2,2,6,6-tetramethylmorpholin-4-yl)propanimidamide

3-(2,2,6,6-tetramethylmorpholin-4-yl)propanimidamide (PubChem CID 102744123) has the molecular formula C11H23N3O and a molecular weight of 213.32 g/mol. Its IUPAC name is 3-(2,2,6,6-tetramethylmorpholin-4-yl)propanimidamide.

Molecular Properties

Compound Name3-(2,2,6,6-tetramethylmorpholin-4-yl)propanimidamide
PubChem CID102744123
Molecular FormulaC11H23N3O
Molecular Weight213.32 g/mol
Exact Mass213.18
IUPAC Name3-(2,2,6,6-tetramethylmorpholin-4-yl)propanimidamide
SMILES[H]/N=C(\N)CCN1CC(C)(C)OC(C)(C)C1
InChIInChI=1S/C11H23N3O/c1-10(2)7-14(6-5-9(12)13)8-11(3,4)15-10/h5-8H2,1-4H3,(H3,12,13)
InChIKeyGZHMCOVZLCCWFD-UHFFFAOYSA-N
XLogP1.20
TPSA62.34 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.32
LogP ≤ 51.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

3-(3-hydroxy-3-methylazetidin-1-yl)propanimidamide
CID 130979083
2,2-dimethyl-4-(2,2,6,6-tetramethylmorpholin-4-yl)butanimidamide
CID 102744138
3-(2,2,6,6-tetramethylmorpholin-4-yl)propanoic acid
CID 102744515
3-(4-methylpiperazin-1-yl)propanimidamide
CID 24709973
4-(3,3,4-trimethylpiperazin-1-yl)butanimidamide
CID 63610574
4-(2,2,6,6-tetramethylmorpholin-4-yl)butan-1-ol
CID 102745117
2,2-dimethyl-4-(2,2,6,6-tetramethylmorpholin-4-yl)butanethioamide
CID 102743969
2-methyl-4-(2,2,6,6-tetramethylmorpholin-4-yl)butan-2-ol
CID 102745123
1-amino-2-methyl-4-(2,2,6,6-tetramethylmorpholin-4-yl)butan-2-ol
CID 102746437
1-phenyl-3-(2,2,6,6-tetramethylmorpholin-4-yl)propan-1-one
CID 102744768
3-[4-[3-[1-(3-amino-3-iminopropyl)piperidin-4-yl]propyl]piperidin-1-yl]propanimidamide
CID 4108841
2-methyl-6-(2,2,6,6-tetramethylmorpholin-4-yl)hexan-3-one
CID 165459746

Frequently Asked Questions

What is the IUPAC name of 3-(2,2,6,6-tetramethylmorpholin-4-yl)propanimidamide?
The IUPAC name of 3-(2,2,6,6-tetramethylmorpholin-4-yl)propanimidamide (CID 102744123) is 3-(2,2,6,6-tetramethylmorpholin-4-yl)propanimidamide.
What is the SMILES notation for 3-(2,2,6,6-tetramethylmorpholin-4-yl)propanimidamide?
The canonical SMILES for 3-(2,2,6,6-tetramethylmorpholin-4-yl)propanimidamide is [H]/N=C(\N)CCN1CC(C)(C)OC(C)(C)C1.
What is the InChIKey of 3-(2,2,6,6-tetramethylmorpholin-4-yl)propanimidamide?
The InChIKey is GZHMCOVZLCCWFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23N3O/c1-10(2)7-14(6-5-9(12)13)8-11(3,4)15-10/h5-8H2,1-4H3,(H3,12,13).
What are the key properties of 3-(2,2,6,6-tetramethylmorpholin-4-yl)propanimidamide?
3-(2,2,6,6-tetramethylmorpholin-4-yl)propanimidamide has a molecular weight of 213.32 g/mol, XLogP of 1.20, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2,2,6,6-tetramethylmorpholin-4-yl)propanimidamide is sourced from PubChem (CID 102744123), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).