(3R)-N'-hydroxy-3-methylpiperidine-1-carboximidamide

C7H15N3O — CID 166099569

IUPAC(3R)-N'-hydroxy-3-methylpiperidine-1-carboximidamide
SMILESC[C@@H]1CCCN(/C(N)=N\O)C1
InChIInChI=1S/C7H15N3O/c1-6-3-2-4-10(5-6)7(8)9-11/h6,11H,2-5H2,1H3,(H2,8,9)/t6-/m1/s1
InChIKeyHEIXEIODPHUJDD-ZCFIWIBFSA-N
MW157.22 g/mol
LogP0.42
Rot. Bonds

About (3R)-N'-hydroxy-3-methylpiperidine-1-carboximidamide

(3R)-N'-hydroxy-3-methylpiperidine-1-carboximidamide (PubChem CID 166099569) has the molecular formula C7H15N3O and a molecular weight of 157.22 g/mol. Its IUPAC name is (3R)-N'-hydroxy-3-methylpiperidine-1-carboximidamide.

Molecular Properties

Compound Name(3R)-N'-hydroxy-3-methylpiperidine-1-carboximidamide
PubChem CID166099569
Molecular FormulaC7H15N3O
Molecular Weight157.22 g/mol
Exact Mass157.12
IUPAC Name(3R)-N'-hydroxy-3-methylpiperidine-1-carboximidamide
SMILESC[C@@H]1CCCN(/C(N)=N\O)C1
InChIInChI=1S/C7H15N3O/c1-6-3-2-4-10(5-6)7(8)9-11/h6,11H,2-5H2,1H3,(H2,8,9)/t6-/m1/s1
InChIKeyHEIXEIODPHUJDD-ZCFIWIBFSA-N
XLogP0.42
TPSA61.85 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.22
LogP ≤ 50.42
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': 'oxime_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

3-methyl-N'-(2-methylcyclobutyl)piperidine-1-carboximidamide
CID 120974001
3-methyl-N'-[(1-methylpyrrolidin-2-yl)methyl]piperidine-1-carboximidamide
CID 111076809
3-methylpiperidine-1-carboxamide
CID 16786142
(3R)-3-methyl-N'-(2-methylsulfanylethyl)piperidine-1-carboximidamide
CID 100673266
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'-hydroxy-1-(3-methylpiperidine-1-carbonyl)cyclopentane-1-carboximidamide
CID 76920228
N'-[(1-hydroxycyclopentyl)methyl]-3-methylpiperidine-1-carboximidamide;hydroiodide
CID 111088654
3-methyl-N'-[4-(3-methylpiperidin-1-yl)butyl]piperidine-1-carboximidamide
CID 111060279
3-methyl-N'-[3-(4-methylpiperidin-1-yl)propyl]piperidine-1-carboximidamide
CID 111034873
N'-(3-methoxypropyl)-3-methylpiperidine-1-carboximidamide;hydroiodide
CID 91642293

Frequently Asked Questions

What is the IUPAC name of (3R)-N'-hydroxy-3-methylpiperidine-1-carboximidamide?
The IUPAC name of (3R)-N'-hydroxy-3-methylpiperidine-1-carboximidamide (CID 166099569) is (3R)-N'-hydroxy-3-methylpiperidine-1-carboximidamide.
What is the SMILES notation for (3R)-N'-hydroxy-3-methylpiperidine-1-carboximidamide?
The canonical SMILES for (3R)-N'-hydroxy-3-methylpiperidine-1-carboximidamide is C[C@@H]1CCCN(/C(N)=N\O)C1.
What is the InChIKey of (3R)-N'-hydroxy-3-methylpiperidine-1-carboximidamide?
The InChIKey is HEIXEIODPHUJDD-ZCFIWIBFSA-N. The full InChI is InChI=1S/C7H15N3O/c1-6-3-2-4-10(5-6)7(8)9-11/h6,11H,2-5H2,1H3,(H2,8,9)/t6-/m1/s1.
What are the key properties of (3R)-N'-hydroxy-3-methylpiperidine-1-carboximidamide?
(3R)-N'-hydroxy-3-methylpiperidine-1-carboximidamide has a molecular weight of 157.22 g/mol, XLogP of 0.42, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-N'-hydroxy-3-methylpiperidine-1-carboximidamide is sourced from PubChem (CID 166099569), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).