N'-(cyclobutylmethyl)-2-methylmorpholine-4-carboximidamide

C11H21N3O — CID 120661244

IUPACN'-(cyclobutylmethyl)-2-methylmorpholine-4-carboximidamide
SMILESCC1CN(/C(N)=N/CC2CCC2)CCO1
InChIInChI=1S/C11H21N3O/c1-9-8-14(5-6-15-9)11(12)13-7-10-3-2-4-10/h9-10H,2-8H2,1H3,(H2,12,13)
InChIKeyQAPFDSVXWNUPGE-UHFFFAOYSA-N
MW211.31 g/mol
LogP0.82
Rot. Bonds2

About N'-(cyclobutylmethyl)-2-methylmorpholine-4-carboximidamide

N'-(cyclobutylmethyl)-2-methylmorpholine-4-carboximidamide (PubChem CID 120661244) has the molecular formula C11H21N3O and a molecular weight of 211.31 g/mol. Its IUPAC name is N'-(cyclobutylmethyl)-2-methylmorpholine-4-carboximidamide.

Molecular Properties

Compound NameN'-(cyclobutylmethyl)-2-methylmorpholine-4-carboximidamide
PubChem CID120661244
Molecular FormulaC11H21N3O
Molecular Weight211.31 g/mol
Exact Mass211.17
IUPAC NameN'-(cyclobutylmethyl)-2-methylmorpholine-4-carboximidamide
SMILESCC1CN(/C(N)=N/CC2CCC2)CCO1
InChIInChI=1S/C11H21N3O/c1-9-8-14(5-6-15-9)11(12)13-7-10-3-2-4-10/h9-10H,2-8H2,1H3,(H2,12,13)
InChIKeyQAPFDSVXWNUPGE-UHFFFAOYSA-N
XLogP0.82
TPSA50.85 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.31
LogP ≤ 50.82
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'}

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Related Compounds

2-methyl-N'-[(3-methylcyclohexyl)methyl]morpholine-4-carboximidamide;hydroiodide
CID 120661395
2-methyl-N'-[(2-methyloxan-4-yl)methyl]morpholine-4-carboximidamide
CID 120662006
2-methyl-N'-[(3-methylcyclopentyl)methyl]morpholine-4-carboximidamide
CID 120663210
2-methyl-N'-(5-oxaspiro[3.5]nonan-8-ylmethyl)morpholine-4-carboximidamide
CID 122097485
2-methyl-N'-[(2-propan-2-yloxan-4-yl)methyl]morpholine-4-carboximidamide
CID 122097698
N'-(3-cyclopropyl-3-methylbutyl)-2-methylmorpholine-4-carboximidamide
CID 122096622
3-methyl-N'-[(4-methylmorpholin-2-yl)methyl]piperidine-1-carboximidamide
CID 111091304
2-methyl-N'-(2-oxo-2-pyrrolidin-1-ylethyl)morpholine-4-carboximidamide;hydroiodide
CID 120661161
2-methyl-N'-[[1-[(2-methyl-1,3-thiazol-4-yl)methyl]piperidin-4-yl]methyl]morpholine-4-carboximidamide;hydroiodide
CID 120661665
N'-[2-(1-hydroxycyclobutyl)ethyl]-2-methylmorpholine-4-carboximidamide
CID 120913754
2-methyl-N'-[2-(4-methylpiperidin-1-yl)ethyl]morpholine-4-carboximidamide;hydroiodide
CID 120661211
N'-[(1-methoxycyclopentyl)methyl]-2-methylmorpholine-4-carboximidamide
CID 122096742

Frequently Asked Questions

What is the IUPAC name of N'-(cyclobutylmethyl)-2-methylmorpholine-4-carboximidamide?
The IUPAC name of N'-(cyclobutylmethyl)-2-methylmorpholine-4-carboximidamide (CID 120661244) is N'-(cyclobutylmethyl)-2-methylmorpholine-4-carboximidamide.
What is the SMILES notation for N'-(cyclobutylmethyl)-2-methylmorpholine-4-carboximidamide?
The canonical SMILES for N'-(cyclobutylmethyl)-2-methylmorpholine-4-carboximidamide is CC1CN(/C(N)=N/CC2CCC2)CCO1.
What is the InChIKey of N'-(cyclobutylmethyl)-2-methylmorpholine-4-carboximidamide?
The InChIKey is QAPFDSVXWNUPGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N3O/c1-9-8-14(5-6-15-9)11(12)13-7-10-3-2-4-10/h9-10H,2-8H2,1H3,(H2,12,13).
What are the key properties of N'-(cyclobutylmethyl)-2-methylmorpholine-4-carboximidamide?
N'-(cyclobutylmethyl)-2-methylmorpholine-4-carboximidamide has a molecular weight of 211.31 g/mol, XLogP of 0.82, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(cyclobutylmethyl)-2-methylmorpholine-4-carboximidamide is sourced from PubChem (CID 120661244), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).