4-hydroxypiperidine-1-carboximidamide;hydrochloride

C6H14ClN3O — CID 67438458

IUPAC4-hydroxypiperidine-1-carboximidamide;hydrochloride
SMILESCl.[H]/N=C(\N)N1CCC(O)CC1
InChIInChI=1S/C6H13N3O.ClH/c7-6(8)9-3-1-5(10)2-4-9;/h5,10H,1-4H2,(H3,7,8);1H
InChIKeyOZHNUGAJQDNLDL-UHFFFAOYSA-N
MW179.65 g/mol
LogP-0.24
Rot. Bonds

About 4-hydroxypiperidine-1-carboximidamide;hydrochloride

4-hydroxypiperidine-1-carboximidamide;hydrochloride (PubChem CID 67438458) has the molecular formula C6H14ClN3O and a molecular weight of 179.65 g/mol. Its IUPAC name is 4-hydroxypiperidine-1-carboximidamide;hydrochloride.

Molecular Properties

Compound Name4-hydroxypiperidine-1-carboximidamide;hydrochloride
PubChem CID67438458
Molecular FormulaC6H14ClN3O
Molecular Weight179.65 g/mol
Exact Mass179.08
IUPAC Name4-hydroxypiperidine-1-carboximidamide;hydrochloride
SMILESCl.[H]/N=C(\N)N1CCC(O)CC1
InChIInChI=1S/C6H13N3O.ClH/c7-6(8)9-3-1-5(10)2-4-9;/h5,10H,1-4H2,(H3,7,8);1H
InChIKeyOZHNUGAJQDNLDL-UHFFFAOYSA-N
XLogP-0.24
TPSA73.34 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.65
LogP ≤ 5-0.24
H-Bond Donors ≤ 53
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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Frequently Asked Questions

What is the IUPAC name of 4-hydroxypiperidine-1-carboximidamide;hydrochloride?
The IUPAC name of 4-hydroxypiperidine-1-carboximidamide;hydrochloride (CID 67438458) is 4-hydroxypiperidine-1-carboximidamide;hydrochloride.
What is the SMILES notation for 4-hydroxypiperidine-1-carboximidamide;hydrochloride?
The canonical SMILES for 4-hydroxypiperidine-1-carboximidamide;hydrochloride is Cl.[H]/N=C(\N)N1CCC(O)CC1.
What is the InChIKey of 4-hydroxypiperidine-1-carboximidamide;hydrochloride?
The InChIKey is OZHNUGAJQDNLDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13N3O.ClH/c7-6(8)9-3-1-5(10)2-4-9;/h5,10H,1-4H2,(H3,7,8);1H.
What are the key properties of 4-hydroxypiperidine-1-carboximidamide;hydrochloride?
4-hydroxypiperidine-1-carboximidamide;hydrochloride has a molecular weight of 179.65 g/mol, XLogP of -0.24, 0 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydroxypiperidine-1-carboximidamide;hydrochloride is sourced from PubChem (CID 67438458), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).