N'-ethyl-3-methoxy-3-methylpiperidine-1-carboximidamide

C10H21N3O — CID 107393146

IUPACN'-ethyl-3-methoxy-3-methylpiperidine-1-carboximidamide
SMILESCC/N=C(\N)N1CCCC(C)(OC)C1
InChIInChI=1S/C10H21N3O/c1-4-12-9(11)13-7-5-6-10(2,8-13)14-3/h4-8H2,1-3H3,(H2,11,12)
InChIKeyFTPJLNIBNPHLGM-UHFFFAOYSA-N
MW199.30 g/mol
LogP0.82
Rot. Bonds2

About N'-ethyl-3-methoxy-3-methylpiperidine-1-carboximidamide

N'-ethyl-3-methoxy-3-methylpiperidine-1-carboximidamide (PubChem CID 107393146) has the molecular formula C10H21N3O and a molecular weight of 199.30 g/mol. Its IUPAC name is N'-ethyl-3-methoxy-3-methylpiperidine-1-carboximidamide.

Molecular Properties

Compound NameN'-ethyl-3-methoxy-3-methylpiperidine-1-carboximidamide
PubChem CID107393146
Molecular FormulaC10H21N3O
Molecular Weight199.30 g/mol
Exact Mass199.17
IUPAC NameN'-ethyl-3-methoxy-3-methylpiperidine-1-carboximidamide
SMILESCC/N=C(\N)N1CCCC(C)(OC)C1
InChIInChI=1S/C10H21N3O/c1-4-12-9(11)13-7-5-6-10(2,8-13)14-3/h4-8H2,1-3H3,(H2,11,12)
InChIKeyFTPJLNIBNPHLGM-UHFFFAOYSA-N
XLogP0.82
TPSA50.85 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.30
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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Frequently Asked Questions

What is the IUPAC name of N'-ethyl-3-methoxy-3-methylpiperidine-1-carboximidamide?
The IUPAC name of N'-ethyl-3-methoxy-3-methylpiperidine-1-carboximidamide (CID 107393146) is N'-ethyl-3-methoxy-3-methylpiperidine-1-carboximidamide.
What is the SMILES notation for N'-ethyl-3-methoxy-3-methylpiperidine-1-carboximidamide?
The canonical SMILES for N'-ethyl-3-methoxy-3-methylpiperidine-1-carboximidamide is CC/N=C(\N)N1CCCC(C)(OC)C1.
What is the InChIKey of N'-ethyl-3-methoxy-3-methylpiperidine-1-carboximidamide?
The InChIKey is FTPJLNIBNPHLGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21N3O/c1-4-12-9(11)13-7-5-6-10(2,8-13)14-3/h4-8H2,1-3H3,(H2,11,12).
What are the key properties of N'-ethyl-3-methoxy-3-methylpiperidine-1-carboximidamide?
N'-ethyl-3-methoxy-3-methylpiperidine-1-carboximidamide has a molecular weight of 199.30 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'-ethyl-3-methoxy-3-methylpiperidine-1-carboximidamide is sourced from PubChem (CID 107393146), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).