4-(2-hydroxyethyl)piperidine-1-carbaldehyde

C8H15NO2 — CID 7330460

IUPAC4-(2-hydroxyethyl)piperidine-1-carbaldehyde
SMILESO=CN1CCC(CCO)CC1
InChIInChI=1S/C8H15NO2/c10-6-3-8-1-4-9(7-11)5-2-8/h7-8,10H,1-6H2
InChIKeyDANYAIYXZFDQGL-UHFFFAOYSA-N
MW157.21 g/mol
LogP0.24
Rot. Bonds3

About 4-(2-hydroxyethyl)piperidine-1-carbaldehyde

4-(2-hydroxyethyl)piperidine-1-carbaldehyde (PubChem CID 7330460) has the molecular formula C8H15NO2 and a molecular weight of 157.21 g/mol. Its IUPAC name is 4-(2-hydroxyethyl)piperidine-1-carbaldehyde.

Molecular Properties

Compound Name4-(2-hydroxyethyl)piperidine-1-carbaldehyde
PubChem CID7330460
Molecular FormulaC8H15NO2
Molecular Weight157.21 g/mol
Exact Mass157.11
IUPAC Name4-(2-hydroxyethyl)piperidine-1-carbaldehyde
SMILESO=CN1CCC(CCO)CC1
InChIInChI=1S/C8H15NO2/c10-6-3-8-1-4-9(7-11)5-2-8/h7-8,10H,1-6H2
InChIKeyDANYAIYXZFDQGL-UHFFFAOYSA-N
XLogP0.24
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.21
LogP ≤ 50.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Related Compounds

3-(hydroxymethyl)pyrrolidine-1-carbaldehyde
CID 62372559
4-[2-(dimethylamino)ethyl]piperidine-1-carbaldehyde
CID 87381497
4-(hydroxymethyl)piperidine-1-carbaldehyde;2-methoxy-2-methylpropane
CID 143881000
2-(1-formylpiperidin-4-yl)ethyl 4-methylbenzenesulfonate;4-(2-hydroxyethyl)piperidine-1-carbaldehyde
CID 158185948
4-(bromomethyl)piperidine-1-carbaldehyde
CID 19812293
carbamic acid;[4-(2-hydroxyethyl)piperidin-1-yl]methylidenecarbamic acid
CID 68518607
4-[3-(methylamino)propyl]piperidine-1-carbaldehyde
CID 166684107
(1-formylpiperidin-4-yl)methylcarbamic acid
CID 156534111
3-[3-(2-hydroxyethyl)pyrrolidin-1-yl]-2,2-dimethylpropanal
CID 114800023
cyclopropyl-[4-(2-hydroxyethyl)piperidin-1-yl]methanone
CID 121200495
2-[3-(2-hydroxyethyl)pyrrolidin-1-yl]benzaldehyde
CID 114798182
2-cyclopentylacetaldehyde;2-cyclopentylethanol
CID 158462189

Frequently Asked Questions

What is the IUPAC name of 4-(2-hydroxyethyl)piperidine-1-carbaldehyde?
The IUPAC name of 4-(2-hydroxyethyl)piperidine-1-carbaldehyde (CID 7330460) is 4-(2-hydroxyethyl)piperidine-1-carbaldehyde.
What is the SMILES notation for 4-(2-hydroxyethyl)piperidine-1-carbaldehyde?
The canonical SMILES for 4-(2-hydroxyethyl)piperidine-1-carbaldehyde is O=CN1CCC(CCO)CC1.
What is the InChIKey of 4-(2-hydroxyethyl)piperidine-1-carbaldehyde?
The InChIKey is DANYAIYXZFDQGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15NO2/c10-6-3-8-1-4-9(7-11)5-2-8/h7-8,10H,1-6H2.
What are the key properties of 4-(2-hydroxyethyl)piperidine-1-carbaldehyde?
4-(2-hydroxyethyl)piperidine-1-carbaldehyde has a molecular weight of 157.21 g/mol, XLogP of 0.24, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-hydroxyethyl)piperidine-1-carbaldehyde is sourced from PubChem (CID 7330460), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).