3-methyl-N'-(2-methylcyclobutyl)piperidine-1-carboximidamide

C12H23N3 — CID 120974001

IUPAC3-methyl-N'-(2-methylcyclobutyl)piperidine-1-carboximidamide
SMILESCC1CCCN(/C(N)=N/C2CCC2C)C1
InChIInChI=1S/C12H23N3/c1-9-4-3-7-15(8-9)12(13)14-11-6-5-10(11)2/h9-11H,3-8H2,1-2H3,(H2,13,14)
InChIKeyFSWMQIDKNCODGR-UHFFFAOYSA-N
MW209.34 g/mol
LogP1.83
Rot. Bonds1

About 3-methyl-N'-(2-methylcyclobutyl)piperidine-1-carboximidamide

3-methyl-N'-(2-methylcyclobutyl)piperidine-1-carboximidamide (PubChem CID 120974001) has the molecular formula C12H23N3 and a molecular weight of 209.34 g/mol. Its IUPAC name is 3-methyl-N'-(2-methylcyclobutyl)piperidine-1-carboximidamide.

Molecular Properties

Compound Name3-methyl-N'-(2-methylcyclobutyl)piperidine-1-carboximidamide
PubChem CID120974001
Molecular FormulaC12H23N3
Molecular Weight209.34 g/mol
Exact Mass209.19
IUPAC Name3-methyl-N'-(2-methylcyclobutyl)piperidine-1-carboximidamide
SMILESCC1CCCN(/C(N)=N/C2CCC2C)C1
InChIInChI=1S/C12H23N3/c1-9-4-3-7-15(8-9)12(13)14-11-6-5-10(11)2/h9-11H,3-8H2,1-2H3,(H2,13,14)
InChIKeyFSWMQIDKNCODGR-UHFFFAOYSA-N
XLogP1.83
TPSA41.62 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.34
LogP ≤ 51.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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'-(2-methylcyclobutyl)morpholine-4-carboximidamide;hydroiodide
CID 120974006
(3R)-N'-hydroxy-3-methylpiperidine-1-carboximidamide
CID 166099569
3-methyl-N'-[(1R,2R)-2-propylcyclopropyl]piperidine-1-carboximidamide;hydroiodide
CID 120666131
3-methylpiperidine-1-carboxamide
CID 16786142
2-[[amino-(3-methylpiperidin-1-yl)methylidene]amino]-N-cyclopropylacetamide;hydroiodide
CID 111034680
(3R)-3-methyl-N'-(2-methylsulfanylethyl)piperidine-1-carboximidamide
CID 100673266
N'-[(1R,2S)-2-(3-methoxyphenyl)cyclopropyl]-3-methylpiperidine-1-carboximidamide
CID 122097958
3-methyl-N'-[(1-methylpyrrolidin-2-yl)methyl]piperidine-1-carboximidamide
CID 111076809
N'-(3-hydroxy-2-methylpropyl)-3-methylpiperidine-1-carboximidamide
CID 111076526
N'-[2-(diethylamino)ethyl]-3-methylpiperidine-1-carboximidamide
CID 111022707
3-methyl-N'-(4-methylpent-1-yn-3-yl)piperidine-1-carboximidamide
CID 120679758
N'-[(1-hydroxycyclopentyl)methyl]-3-methylpiperidine-1-carboximidamide;hydroiodide
CID 111088654

Frequently Asked Questions

What is the IUPAC name of 3-methyl-N'-(2-methylcyclobutyl)piperidine-1-carboximidamide?
The IUPAC name of 3-methyl-N'-(2-methylcyclobutyl)piperidine-1-carboximidamide (CID 120974001) is 3-methyl-N'-(2-methylcyclobutyl)piperidine-1-carboximidamide.
What is the SMILES notation for 3-methyl-N'-(2-methylcyclobutyl)piperidine-1-carboximidamide?
The canonical SMILES for 3-methyl-N'-(2-methylcyclobutyl)piperidine-1-carboximidamide is CC1CCCN(/C(N)=N/C2CCC2C)C1.
What is the InChIKey of 3-methyl-N'-(2-methylcyclobutyl)piperidine-1-carboximidamide?
The InChIKey is FSWMQIDKNCODGR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23N3/c1-9-4-3-7-15(8-9)12(13)14-11-6-5-10(11)2/h9-11H,3-8H2,1-2H3,(H2,13,14).
What are the key properties of 3-methyl-N'-(2-methylcyclobutyl)piperidine-1-carboximidamide?
3-methyl-N'-(2-methylcyclobutyl)piperidine-1-carboximidamide has a molecular weight of 209.34 g/mol, XLogP of 1.83, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-N'-(2-methylcyclobutyl)piperidine-1-carboximidamide is sourced from PubChem (CID 120974001), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).