4-hydroxypiperidine-1-carboximidate

C6H11N2O2- — CID 145177948

IUPAC4-hydroxypiperidine-1-carboximidate
SMILES[H]/N=C(\[O-])N1CCC(O)CC1
InChIInChI=1S/C6H12N2O2/c7-6(10)8-3-1-5(9)2-4-8/h5,9H,1-4H2,(H2,7,10)/p-1
InChIKeyRUBROIIGKQNJPQ-UHFFFAOYSA-M
MW143.17 g/mol
LogP-1.26
Rot. Bonds

About 4-hydroxypiperidine-1-carboximidate

4-hydroxypiperidine-1-carboximidate (PubChem CID 145177948) has the molecular formula C6H11N2O2- and a molecular weight of 143.17 g/mol. Its IUPAC name is 4-hydroxypiperidine-1-carboximidate.

Molecular Properties

Compound Name4-hydroxypiperidine-1-carboximidate
PubChem CID145177948
Molecular FormulaC6H11N2O2-
Molecular Weight143.17 g/mol
Exact Mass143.08
IUPAC Name4-hydroxypiperidine-1-carboximidate
SMILES[H]/N=C(\[O-])N1CCC(O)CC1
InChIInChI=1S/C6H12N2O2/c7-6(10)8-3-1-5(9)2-4-8/h5,9H,1-4H2,(H2,7,10)/p-1
InChIKeyRUBROIIGKQNJPQ-UHFFFAOYSA-M
XLogP-1.26
TPSA70.38 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.17
LogP ≤ 5-1.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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

ethane;1-ethanimidoylpyrrolidin-3-ol
CID 145296457
4-hydroxypiperidine-1-carbodithioate
CID 90477064
CID 131886792
CID 131886792
(4-hydroxypiperidin-1-yl)-pyrrolidin-1-ylmethanone
CID 112725643
2-(4-hydroxypiperidin-1-yl)-2-oxoacetaldehyde
CID 21030955
N'-amino-4-hydroxypiperidine-1-carboximidamide
CID 77054111
4-hydroxypiperidine-1-sulfinate
CID 66959105
(4-hydroxypiperidin-1-yl)-(4-methylpiperidin-1-yl)methanone
CID 58959877
ethane;4-hydroxy-N,N-dimethylpiperidine-1-carboxamide
CID 177000200
ethane;1-(4-hydroxypiperidin-1-yl)propan-1-one
CID 145216334
1-[(3R)-3-methylpyrrolidin-1-yl]ethanimine
CID 59072020
1-methylpiperidin-4-ol;trihydrochloride
CID 142686130

Frequently Asked Questions

What is the IUPAC name of 4-hydroxypiperidine-1-carboximidate?
The IUPAC name of 4-hydroxypiperidine-1-carboximidate (CID 145177948) is 4-hydroxypiperidine-1-carboximidate.
What is the SMILES notation for 4-hydroxypiperidine-1-carboximidate?
The canonical SMILES for 4-hydroxypiperidine-1-carboximidate is [H]/N=C(\[O-])N1CCC(O)CC1.
What is the InChIKey of 4-hydroxypiperidine-1-carboximidate?
The InChIKey is RUBROIIGKQNJPQ-UHFFFAOYSA-M. The full InChI is InChI=1S/C6H12N2O2/c7-6(10)8-3-1-5(9)2-4-8/h5,9H,1-4H2,(H2,7,10)/p-1.
What are the key properties of 4-hydroxypiperidine-1-carboximidate?
4-hydroxypiperidine-1-carboximidate has a molecular weight of 143.17 g/mol, XLogP of -1.26, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydroxypiperidine-1-carboximidate is sourced from PubChem (CID 145177948), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).