2-imino-2-(4-methylpiperidin-1-yl)ethanol

C8H16N2O — CID 20637111

IUPAC2-imino-2-(4-methylpiperidin-1-yl)ethanol
SMILES[H]/N=C(\CO)N1CCC(C)CC1
InChIInChI=1S/C8H16N2O/c1-7-2-4-10(5-3-7)8(9)6-11/h7,9,11H,2-6H2,1H3/b9-8+
InChIKeyAJNZSEOFROFTIW-CMDGGOBGSA-N
MW156.23 g/mol
LogP0.69
Rot. Bonds1

About 2-imino-2-(4-methylpiperidin-1-yl)ethanol

2-imino-2-(4-methylpiperidin-1-yl)ethanol (PubChem CID 20637111) has the molecular formula C8H16N2O and a molecular weight of 156.23 g/mol. Its IUPAC name is 2-imino-2-(4-methylpiperidin-1-yl)ethanol.

Molecular Properties

Compound Name2-imino-2-(4-methylpiperidin-1-yl)ethanol
PubChem CID20637111
Molecular FormulaC8H16N2O
Molecular Weight156.23 g/mol
Exact Mass156.13
IUPAC Name2-imino-2-(4-methylpiperidin-1-yl)ethanol
SMILES[H]/N=C(\CO)N1CCC(C)CC1
InChIInChI=1S/C8H16N2O/c1-7-2-4-10(5-3-7)8(9)6-11/h7,9,11H,2-6H2,1H3/b9-8+
InChIKeyAJNZSEOFROFTIW-CMDGGOBGSA-N
XLogP0.69
TPSA47.32 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.23
LogP ≤ 50.69
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

3-Imino-3-(4-methylpiperidin-1-yl)propan-1-ol
CID 20637163
(1-Ethanimidoylpiperidin-4-yl)methanol
CID 59020702
2-(1-Ethanimidoylpiperidin-4-yl)ethanol
CID 59020836
2-Imino-2-piperidin-1-ylethanol
CID 91460076
2-Methoxy-1-(4-methylpiperidin-1-yl)ethanimine
CID 138749658
Ethane;2-(1-ethanimidoylpiperidin-4-yl)ethanol
CID 142175203
1-(2-Hydroxyethyl)piperidine-4-carboximidamide
CID 144816606
2-[4-(Cyclopentanecarboximidoyl)piperazin-1-yl]ethanol
CID 63179068
2-imino-2-[(3R)-3-methylpiperidin-1-yl]ethanol
CID 100024919
2-imino-2-[(3S)-3-methylpiperidin-1-yl]ethanol
CID 100024921
2-Imino-2-(3-methylpiperidin-1-yl)ethanol
CID 102571155

Frequently Asked Questions

What is the IUPAC name of 2-imino-2-(4-methylpiperidin-1-yl)ethanol?
The IUPAC name of 2-imino-2-(4-methylpiperidin-1-yl)ethanol (CID 20637111) is 2-imino-2-(4-methylpiperidin-1-yl)ethanol.
What is the SMILES notation for 2-imino-2-(4-methylpiperidin-1-yl)ethanol?
The canonical SMILES for 2-imino-2-(4-methylpiperidin-1-yl)ethanol is [H]/N=C(\CO)N1CCC(C)CC1.
What is the InChIKey of 2-imino-2-(4-methylpiperidin-1-yl)ethanol?
The InChIKey is AJNZSEOFROFTIW-CMDGGOBGSA-N. The full InChI is InChI=1S/C8H16N2O/c1-7-2-4-10(5-3-7)8(9)6-11/h7,9,11H,2-6H2,1H3/b9-8+.
What are the key properties of 2-imino-2-(4-methylpiperidin-1-yl)ethanol?
2-imino-2-(4-methylpiperidin-1-yl)ethanol has a molecular weight of 156.23 g/mol, XLogP of 0.69, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-imino-2-(4-methylpiperidin-1-yl)ethanol is sourced from PubChem (CID 20637111), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).