N'-amino-4-methoxypiperidine-1-carboximidamide

C7H16N4O — CID 64868156

IUPACN'-amino-4-methoxypiperidine-1-carboximidamide
SMILESCOC1CCN(/C(N)=N/N)CC1
InChIInChI=1S/C7H16N4O/c1-12-6-2-4-11(5-3-6)7(8)10-9/h6H,2-5,9H2,1H3,(H2,8,10)
InChIKeyZEKDCAAPBOJLPD-UHFFFAOYSA-N
MW172.23 g/mol
LogP-0.71
Rot. Bonds1

About N'-amino-4-methoxypiperidine-1-carboximidamide

N'-amino-4-methoxypiperidine-1-carboximidamide (PubChem CID 64868156) has the molecular formula C7H16N4O and a molecular weight of 172.23 g/mol. Its IUPAC name is N'-amino-4-methoxypiperidine-1-carboximidamide.

Molecular Properties

Compound NameN'-amino-4-methoxypiperidine-1-carboximidamide
PubChem CID64868156
Molecular FormulaC7H16N4O
Molecular Weight172.23 g/mol
Exact Mass172.13
IUPAC NameN'-amino-4-methoxypiperidine-1-carboximidamide
SMILESCOC1CCN(/C(N)=N/N)CC1
InChIInChI=1S/C7H16N4O/c1-12-6-2-4-11(5-3-6)7(8)10-9/h6H,2-5,9H2,1H3,(H2,8,10)
InChIKeyZEKDCAAPBOJLPD-UHFFFAOYSA-N
XLogP-0.71
TPSA76.87 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.23
LogP ≤ 5-0.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

4-Methoxypiperidine-1-carboximidamide hydrobromide
CID 71758599
4-Methoxypiperidine-1-carboximidamide
CID 19089259
4-Ethoxypiperidine-1-carboximidamide
CID 57301153
4-methoxy-N'-methylpiperidine-1-carboximidamide
CID 62360256
4-Methoxypiperidine-1-carboximidamide hydrochloride
CID 142322136
4-methoxy-N,N-dimethylpiperidine-1-carboximidamide;hydrochloride
CID 142322153
4-methoxy-N,N-dimethylpiperidine-1-carboximidamide
CID 142322154
4-Methoxypiperidin-1-ium-1-carboximidamide
CID 173337125
4-ethoxy-N'-methylpiperidine-1-carboximidamide
CID 62358596
N'-ethyl-4-methoxypiperidine-1-carboximidamide
CID 62361882
4-methoxy-N'-propylpiperidine-1-carboximidamide
CID 62361883
4-ethoxy-N'-ethylpiperidine-1-carboximidamide
CID 62362113

Frequently Asked Questions

What is the IUPAC name of N'-amino-4-methoxypiperidine-1-carboximidamide?
The IUPAC name of N'-amino-4-methoxypiperidine-1-carboximidamide (CID 64868156) is N'-amino-4-methoxypiperidine-1-carboximidamide.
What is the SMILES notation for N'-amino-4-methoxypiperidine-1-carboximidamide?
The canonical SMILES for N'-amino-4-methoxypiperidine-1-carboximidamide is COC1CCN(/C(N)=N/N)CC1.
What is the InChIKey of N'-amino-4-methoxypiperidine-1-carboximidamide?
The InChIKey is ZEKDCAAPBOJLPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H16N4O/c1-12-6-2-4-11(5-3-6)7(8)10-9/h6H,2-5,9H2,1H3,(H2,8,10).
What are the key properties of N'-amino-4-methoxypiperidine-1-carboximidamide?
N'-amino-4-methoxypiperidine-1-carboximidamide has a molecular weight of 172.23 g/mol, XLogP of -0.71, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-amino-4-methoxypiperidine-1-carboximidamide is sourced from PubChem (CID 64868156), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).