1-ethanimidoyl-2,6-dimethylpiperidin-4-ol

C9H18N2O — CID 177033685

IUPAC1-ethanimidoyl-2,6-dimethylpiperidin-4-ol
SMILES[H]/N=C(\C)N1C(C)CC(O)CC1C
InChIInChI=1S/C9H18N2O/c1-6-4-9(12)5-7(2)11(6)8(3)10/h6-7,9-10,12H,4-5H2,1-3H3/b10-8+
InChIKeyNARCRBYYBMCRKA-CSKARUKUSA-N
MW170.26 g/mol
LogP1.22
Rot. Bonds

About 1-ethanimidoyl-2,6-dimethylpiperidin-4-ol

1-ethanimidoyl-2,6-dimethylpiperidin-4-ol (PubChem CID 177033685) has the molecular formula C9H18N2O and a molecular weight of 170.26 g/mol. Its IUPAC name is 1-ethanimidoyl-2,6-dimethylpiperidin-4-ol.

Molecular Properties

Compound Name1-ethanimidoyl-2,6-dimethylpiperidin-4-ol
PubChem CID177033685
Molecular FormulaC9H18N2O
Molecular Weight170.26 g/mol
Exact Mass170.14
IUPAC Name1-ethanimidoyl-2,6-dimethylpiperidin-4-ol
SMILES[H]/N=C(\C)N1C(C)CC(O)CC1C
InChIInChI=1S/C9H18N2O/c1-6-4-9(12)5-7(2)11(6)8(3)10/h6-7,9-10,12H,4-5H2,1-3H3/b10-8+
InChIKeyNARCRBYYBMCRKA-CSKARUKUSA-N
XLogP1.22
TPSA47.32 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.26
LogP ≤ 51.22
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'}

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Related Compounds

4-Piperidinol, 1-(1-iminoethyl)-
CID 17891119
1-(1'-Iminoethyl)-4-hydroxypiperidine hydrochloride
CID 21618813
1-Amino-3-(2-iminopiperidin-1-yl)butan-1-ol
CID 57189882
2-Imino-1-methylpiperidin-4-ol
CID 149848535
3-(4-Hydroxypiperidin-1-yl)pentanimidamide
CID 43175060
3-(4-Hydroxypiperidin-1-yl)butanimidamide
CID 60914692
2-(4-Hydroxypiperidin-1-yl)propanimidamide
CID 61691313
2-(4-Hydroxypiperidin-1-yl)butanimidamide
CID 61697915
1-(4-Methoxy-2-methylpiperidin-1-yl)-2-methylpropan-1-imine
CID 126974406
1-(4-Methoxy-2-methylpiperidin-1-yl)ethanimine
CID 130485928
1-(4-Methoxy-2-methylpiperidin-1-yl)propan-1-imine
CID 130485929

Frequently Asked Questions

What is the IUPAC name of 1-ethanimidoyl-2,6-dimethylpiperidin-4-ol?
The IUPAC name of 1-ethanimidoyl-2,6-dimethylpiperidin-4-ol (CID 177033685) is 1-ethanimidoyl-2,6-dimethylpiperidin-4-ol.
What is the SMILES notation for 1-ethanimidoyl-2,6-dimethylpiperidin-4-ol?
The canonical SMILES for 1-ethanimidoyl-2,6-dimethylpiperidin-4-ol is [H]/N=C(\C)N1C(C)CC(O)CC1C.
What is the InChIKey of 1-ethanimidoyl-2,6-dimethylpiperidin-4-ol?
The InChIKey is NARCRBYYBMCRKA-CSKARUKUSA-N. The full InChI is InChI=1S/C9H18N2O/c1-6-4-9(12)5-7(2)11(6)8(3)10/h6-7,9-10,12H,4-5H2,1-3H3/b10-8+.
What are the key properties of 1-ethanimidoyl-2,6-dimethylpiperidin-4-ol?
1-ethanimidoyl-2,6-dimethylpiperidin-4-ol has a molecular weight of 170.26 g/mol, XLogP of 1.22, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethanimidoyl-2,6-dimethylpiperidin-4-ol is sourced from PubChem (CID 177033685), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).