N-amino-N'-(1-methoxypropan-2-yl)morpholine-4-carboximidamide

C9H20N4O2 — CID 104883236

IUPACN-amino-N'-(1-methoxypropan-2-yl)morpholine-4-carboximidamide
SMILESCOCC(C)/N=C(\NN)N1CCOCC1
InChIInChI=1S/C9H20N4O2/c1-8(7-14-2)11-9(12-10)13-3-5-15-6-4-13/h8H,3-7,10H2,1-2H3,(H,11,12)
InChIKeyWHCLZEUYILEICE-UHFFFAOYSA-N
MW216.28 g/mol
LogP-0.83
Rot. Bonds3

About N-amino-N'-(1-methoxypropan-2-yl)morpholine-4-carboximidamide

N-amino-N'-(1-methoxypropan-2-yl)morpholine-4-carboximidamide (PubChem CID 104883236) has the molecular formula C9H20N4O2 and a molecular weight of 216.28 g/mol. Its IUPAC name is N-amino-N'-(1-methoxypropan-2-yl)morpholine-4-carboximidamide.

Molecular Properties

Compound NameN-amino-N'-(1-methoxypropan-2-yl)morpholine-4-carboximidamide
PubChem CID104883236
Molecular FormulaC9H20N4O2
Molecular Weight216.28 g/mol
Exact Mass216.16
IUPAC NameN-amino-N'-(1-methoxypropan-2-yl)morpholine-4-carboximidamide
SMILESCOCC(C)/N=C(\NN)N1CCOCC1
InChIInChI=1S/C9H20N4O2/c1-8(7-14-2)11-9(12-10)13-3-5-15-6-4-13/h8H,3-7,10H2,1-2H3,(H,11,12)
InChIKeyWHCLZEUYILEICE-UHFFFAOYSA-N
XLogP-0.83
TPSA72.11 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.28
LogP ≤ 5-0.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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-propan-2-ylpiperazine-1-carboximidamide
CID 104883911
N-amino-N'-(1-methoxypropan-2-yl)-2-methylmorpholine-4-carboximidamide
CID 104883311
N-amino-N'-(1-methoxypropan-2-yl)-4-methylsulfonylpiperazine-1-carboximidamide
CID 104885840
N-amino-3-methoxy-N'-(1-methoxypropan-2-yl)piperidine-1-carboximidamide
CID 102972043
N-amino-3-ethyl-N'-(1-methoxypropan-2-yl)-4-methylpiperazine-1-carboximidamide
CID 104886119
N-amino-N'-(1-methoxypropan-2-yl)-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazine-2-carboximidamide
CID 104887359
N-amino-N'-(1-methoxypropan-2-yl)-2,3-dimethylpiperidine-1-carboximidamide
CID 104884194
N-amino-N'-(1-methoxypropan-2-yl)-1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazine-2-carboximidamide
CID 104887394
N-amino-N'-(1-methoxypropan-2-yl)-3-methylthiomorpholine-4-carboximidamide
CID 104886403
N-amino-2-[(dimethylamino)methyl]-4-hydroxy-N'-(1-methoxypropan-2-yl)pyrrolidine-1-carboximidamide
CID 104887113
1-amino-3-(1-methoxypropan-2-yl)-2-(2-morpholin-4-ylethyl)guanidine
CID 104883090
N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)morpholine-4-carboxamide
CID 115672440

Frequently Asked Questions

What is the IUPAC name of N-amino-N'-(1-methoxypropan-2-yl)morpholine-4-carboximidamide?
The IUPAC name of N-amino-N'-(1-methoxypropan-2-yl)morpholine-4-carboximidamide (CID 104883236) is N-amino-N'-(1-methoxypropan-2-yl)morpholine-4-carboximidamide.
What is the SMILES notation for N-amino-N'-(1-methoxypropan-2-yl)morpholine-4-carboximidamide?
The canonical SMILES for N-amino-N'-(1-methoxypropan-2-yl)morpholine-4-carboximidamide is COCC(C)/N=C(\NN)N1CCOCC1.
What is the InChIKey of N-amino-N'-(1-methoxypropan-2-yl)morpholine-4-carboximidamide?
The InChIKey is WHCLZEUYILEICE-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20N4O2/c1-8(7-14-2)11-9(12-10)13-3-5-15-6-4-13/h8H,3-7,10H2,1-2H3,(H,11,12).
What are the key properties of N-amino-N'-(1-methoxypropan-2-yl)morpholine-4-carboximidamide?
N-amino-N'-(1-methoxypropan-2-yl)morpholine-4-carboximidamide has a molecular weight of 216.28 g/mol, XLogP of -0.83, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-amino-N'-(1-methoxypropan-2-yl)morpholine-4-carboximidamide is sourced from PubChem (CID 104883236), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).