N'-(2-morpholin-4-ylpropyl)morpholine-4-carboximidamide

C12H24N4O2 — CID 111055185

IUPACN'-(2-morpholin-4-ylpropyl)morpholine-4-carboximidamide
SMILESCC(C/N=C(\N)N1CCOCC1)N1CCOCC1
InChIInChI=1S/C12H24N4O2/c1-11(15-2-6-17-7-3-15)10-14-12(13)16-4-8-18-9-5-16/h11H,2-10H2,1H3,(H2,13,14)
InChIKeyXJZDTQLKXSXZFO-UHFFFAOYSA-N
MW256.35 g/mol
LogP-0.65
Rot. Bonds3

About N'-(2-morpholin-4-ylpropyl)morpholine-4-carboximidamide

N'-(2-morpholin-4-ylpropyl)morpholine-4-carboximidamide (PubChem CID 111055185) has the molecular formula C12H24N4O2 and a molecular weight of 256.35 g/mol. Its IUPAC name is N'-(2-morpholin-4-ylpropyl)morpholine-4-carboximidamide.

Molecular Properties

Compound NameN'-(2-morpholin-4-ylpropyl)morpholine-4-carboximidamide
PubChem CID111055185
Molecular FormulaC12H24N4O2
Molecular Weight256.35 g/mol
Exact Mass256.19
IUPAC NameN'-(2-morpholin-4-ylpropyl)morpholine-4-carboximidamide
SMILESCC(C/N=C(\N)N1CCOCC1)N1CCOCC1
InChIInChI=1S/C12H24N4O2/c1-11(15-2-6-17-7-3-15)10-14-12(13)16-4-8-18-9-5-16/h11H,2-10H2,1H3,(H2,13,14)
InChIKeyXJZDTQLKXSXZFO-UHFFFAOYSA-N
XLogP-0.65
TPSA63.32 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.35
LogP ≤ 5-0.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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

N'-[2-(4-methylpiperazin-1-yl)propyl]morpholine-4-carboximidamide
CID 111090365
N'-[2-(4-methylpiperidin-1-yl)propyl]morpholine-4-carboximidamide;hydroiodide
CID 111086012
4-methyl-N'-(2-morpholin-4-ylpropyl)piperidine-1-carboximidamide;hydroiodide
CID 110919840
1-amino-2-(2-morpholin-4-ylpropyl)guanidine
CID 23126903
1-ethyl-2-(2-morpholin-4-ylpropyl)guanidine
CID 111055251
4-methyl-N'-[2-(4-methylpiperidin-1-yl)propyl]piperidine-1-carboximidamide;hydroiodide
CID 110920423
N'-(2-methoxy-3,3-dimethylbutyl)morpholine-4-carboximidamide
CID 111757981
N'-(4-methyl-2-morpholin-4-ylpentyl)thiomorpholine-4-carboximidamide
CID 111041535
1-cyclopropyl-1-methyl-2-(2-morpholin-4-ylpropyl)guanidine
CID 110030013
N'-[2-(2,3-dihydroindol-1-yl)propyl]morpholine-4-carboximidamide
CID 111067772
1,3-diethyl-2-(2-morpholin-4-ylpropyl)guanidine
CID 110915060
N'-[2-(4-methylpiperazin-1-yl)propyl]thiomorpholine-4-carboximidamide
CID 111090433

Frequently Asked Questions

What is the IUPAC name of N'-(2-morpholin-4-ylpropyl)morpholine-4-carboximidamide?
The IUPAC name of N'-(2-morpholin-4-ylpropyl)morpholine-4-carboximidamide (CID 111055185) is N'-(2-morpholin-4-ylpropyl)morpholine-4-carboximidamide.
What is the SMILES notation for N'-(2-morpholin-4-ylpropyl)morpholine-4-carboximidamide?
The canonical SMILES for N'-(2-morpholin-4-ylpropyl)morpholine-4-carboximidamide is CC(C/N=C(\N)N1CCOCC1)N1CCOCC1.
What is the InChIKey of N'-(2-morpholin-4-ylpropyl)morpholine-4-carboximidamide?
The InChIKey is XJZDTQLKXSXZFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N4O2/c1-11(15-2-6-17-7-3-15)10-14-12(13)16-4-8-18-9-5-16/h11H,2-10H2,1H3,(H2,13,14).
What are the key properties of N'-(2-morpholin-4-ylpropyl)morpholine-4-carboximidamide?
N'-(2-morpholin-4-ylpropyl)morpholine-4-carboximidamide has a molecular weight of 256.35 g/mol, XLogP of -0.65, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(2-morpholin-4-ylpropyl)morpholine-4-carboximidamide is sourced from PubChem (CID 111055185), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).