N-cyclobutyl-4-hydroxy-N'-methylpiperidine-1-carboximidamide;hydroiodide

C11H22IN3O — CID 119153414

IUPACN-cyclobutyl-4-hydroxy-N'-methylpiperidine-1-carboximidamide;hydroiodide
SMILESC/N=C(/NC1CCC1)N1CCC(O)CC1.I
InChIInChI=1S/C11H21N3O.HI/c1-12-11(13-9-3-2-4-9)14-7-5-10(15)6-8-14;/h9-10,15H,2-8H2,1H3,(H,12,13);1H
InChIKeySRNZJOZGTIETGV-UHFFFAOYSA-N
MW339.22 g/mol
LogP1.19
Rot. Bonds1

About N-cyclobutyl-4-hydroxy-N'-methylpiperidine-1-carboximidamide;hydroiodide

N-cyclobutyl-4-hydroxy-N'-methylpiperidine-1-carboximidamide;hydroiodide (PubChem CID 119153414) has the molecular formula C11H22IN3O and a molecular weight of 339.22 g/mol. Its IUPAC name is N-cyclobutyl-4-hydroxy-N'-methylpiperidine-1-carboximidamide;hydroiodide.

Molecular Properties

Compound NameN-cyclobutyl-4-hydroxy-N'-methylpiperidine-1-carboximidamide;hydroiodide
PubChem CID119153414
Molecular FormulaC11H22IN3O
Molecular Weight339.22 g/mol
Exact Mass339.08
IUPAC NameN-cyclobutyl-4-hydroxy-N'-methylpiperidine-1-carboximidamide;hydroiodide
SMILESC/N=C(/NC1CCC1)N1CCC(O)CC1.I
InChIInChI=1S/C11H21N3O.HI/c1-12-11(13-9-3-2-4-9)14-7-5-10(15)6-8-14;/h9-10,15H,2-8H2,1H3,(H,12,13);1H
InChIKeySRNZJOZGTIETGV-UHFFFAOYSA-N
XLogP1.19
TPSA47.86 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.22
LogP ≤ 51.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}, {'alert_name': 'iodine', 'substructure': 'N/A'}

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Related Compounds

N-cyclopropyl-N'-methylpyrrolidine-1-carboximidamide
CID 131225012
N-(cyclobutylmethyl)-4-hydroxy-N'-methylpiperidine-1-carboximidamide;hydroiodide
CID 75482169
N-cyclobutyl-N'-methyl-3-(2-methylpropyl)pyrrolidine-1-carboximidamide;hydroiodide
CID 119154085
N-cyclobutyl-3-(ethoxymethyl)-N'-methylpyrrolidine-1-carboximidamide;hydroiodide
CID 119154357
2-[4-(N-cyclobutyl-N'-methylcarbamimidoyl)piperazin-1-yl]-N-propan-2-ylacetamide;hydroiodide
CID 119153497
N-cyclobutyl-4-(2-fluorophenyl)-N'-methylpiperazine-1-carboximidamide
CID 119153263
4-hydroxy-N-(3-methoxy-2,2,3-trimethylcyclobutyl)-N'-methylpiperidine-1-carboximidamide
CID 119161399
N-cyclopropyl-N'-methyl-2-azaspiro[4.4]nonane-2-carboximidamide;hydroiodide
CID 111732530
N-cyclobutyl-4-(3-methoxyphenyl)-N'-methylpiperazine-1-carboximidamide;hydroiodide
CID 119153328
N-cyclobutyl-4-(furan-2-carbonyl)-N'-methylpiperazine-1-carboximidamide
CID 119153283
N-cyclopropyl-N'-methyl-3-pentan-3-ylpyrrolidine-1-carboximidamide
CID 111743695
N-cyclopropyl-N'-methyl-3-phenylpyrrolidine-1-carboximidamide
CID 111722895

Frequently Asked Questions

What is the IUPAC name of N-cyclobutyl-4-hydroxy-N'-methylpiperidine-1-carboximidamide;hydroiodide?
The IUPAC name of N-cyclobutyl-4-hydroxy-N'-methylpiperidine-1-carboximidamide;hydroiodide (CID 119153414) is N-cyclobutyl-4-hydroxy-N'-methylpiperidine-1-carboximidamide;hydroiodide.
What is the SMILES notation for N-cyclobutyl-4-hydroxy-N'-methylpiperidine-1-carboximidamide;hydroiodide?
The canonical SMILES for N-cyclobutyl-4-hydroxy-N'-methylpiperidine-1-carboximidamide;hydroiodide is C/N=C(/NC1CCC1)N1CCC(O)CC1.I.
What is the InChIKey of N-cyclobutyl-4-hydroxy-N'-methylpiperidine-1-carboximidamide;hydroiodide?
The InChIKey is SRNZJOZGTIETGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N3O.HI/c1-12-11(13-9-3-2-4-9)14-7-5-10(15)6-8-14;/h9-10,15H,2-8H2,1H3,(H,12,13);1H.
What are the key properties of N-cyclobutyl-4-hydroxy-N'-methylpiperidine-1-carboximidamide;hydroiodide?
N-cyclobutyl-4-hydroxy-N'-methylpiperidine-1-carboximidamide;hydroiodide has a molecular weight of 339.22 g/mol, XLogP of 1.19, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclobutyl-4-hydroxy-N'-methylpiperidine-1-carboximidamide;hydroiodide is sourced from PubChem (CID 119153414), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).