4-methoxy-N,N-dimethylpiperidine-1-carboximidamide;hydrochloride

C9H20ClN3O — CID 142322153

IUPAC4-methoxy-N,N-dimethylpiperidine-1-carboximidamide;hydrochloride
SMILESCl.[H]/N=C(\N(C)C)N1CCC(OC)CC1
InChIInChI=1S/C9H19N3O.ClH/c1-11(2)9(10)12-6-4-8(13-3)5-7-12;/h8,10H,4-7H2,1-3H3;1H/b10-9+;
InChIKeyRIDWMVTYSHKCKO-RRABGKBLSA-N
MW221.73 g/mol
LogP1.02
Rot. Bonds1

About 4-methoxy-N,N-dimethylpiperidine-1-carboximidamide;hydrochloride

4-methoxy-N,N-dimethylpiperidine-1-carboximidamide;hydrochloride (PubChem CID 142322153) has the molecular formula C9H20ClN3O and a molecular weight of 221.73 g/mol. Its IUPAC name is 4-methoxy-N,N-dimethylpiperidine-1-carboximidamide;hydrochloride.

Molecular Properties

Compound Name4-methoxy-N,N-dimethylpiperidine-1-carboximidamide;hydrochloride
PubChem CID142322153
Molecular FormulaC9H20ClN3O
Molecular Weight221.73 g/mol
Exact Mass221.13
IUPAC Name4-methoxy-N,N-dimethylpiperidine-1-carboximidamide;hydrochloride
SMILESCl.[H]/N=C(\N(C)C)N1CCC(OC)CC1
InChIInChI=1S/C9H19N3O.ClH/c1-11(2)9(10)12-6-4-8(13-3)5-7-12;/h8,10H,4-7H2,1-3H3;1H/b10-9+;
InChIKeyRIDWMVTYSHKCKO-RRABGKBLSA-N
XLogP1.02
TPSA39.56 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.73
LogP ≤ 51.02
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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Related Compounds

4-Methoxypiperidine-1-carboximidamide hydrobromide
CID 71758599
4-Methoxypiperidine-1-carboximidamide
CID 19089259
1-(4-Methoxypiperidin-1-yl)ethanimine
CID 18727529
4-hydroxy-N,N-dimethylpiperidine-1-carboximidamide
CID 53919786
4-Ethoxypiperidine-1-carboximidamide
CID 57301153
4-methoxy-N'-methylpiperidine-1-carboximidamide
CID 62360256
4-hydroxy-N,N-dimethylpiperidine-1-carboximidamide;hydrochloride
CID 70047066
4-methoxy-N-methylidenepiperidine-1-carboximidamide
CID 123914976
(4-Methoxypiperidin-1-yl)methanimine
CID 142135102
4-Methoxypiperidine-1-carboximidamide hydrochloride
CID 142322136
4-methoxy-N,N-dimethylpiperidine-1-carboximidamide
CID 142322154
Methane;1-(4-methoxypiperidin-1-yl)ethanimine
CID 159843772

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-N,N-dimethylpiperidine-1-carboximidamide;hydrochloride?
The IUPAC name of 4-methoxy-N,N-dimethylpiperidine-1-carboximidamide;hydrochloride (CID 142322153) is 4-methoxy-N,N-dimethylpiperidine-1-carboximidamide;hydrochloride.
What is the SMILES notation for 4-methoxy-N,N-dimethylpiperidine-1-carboximidamide;hydrochloride?
The canonical SMILES for 4-methoxy-N,N-dimethylpiperidine-1-carboximidamide;hydrochloride is Cl.[H]/N=C(\N(C)C)N1CCC(OC)CC1.
What is the InChIKey of 4-methoxy-N,N-dimethylpiperidine-1-carboximidamide;hydrochloride?
The InChIKey is RIDWMVTYSHKCKO-RRABGKBLSA-N. The full InChI is InChI=1S/C9H19N3O.ClH/c1-11(2)9(10)12-6-4-8(13-3)5-7-12;/h8,10H,4-7H2,1-3H3;1H/b10-9+;.
What are the key properties of 4-methoxy-N,N-dimethylpiperidine-1-carboximidamide;hydrochloride?
4-methoxy-N,N-dimethylpiperidine-1-carboximidamide;hydrochloride has a molecular weight of 221.73 g/mol, XLogP of 1.02, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-N,N-dimethylpiperidine-1-carboximidamide;hydrochloride is sourced from PubChem (CID 142322153), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).