5-(2-hydroxyethylamino)pyridine-2-carbaldehyde

C8H10N2O2 — CID 167016438

IUPAC5-(2-hydroxyethylamino)pyridine-2-carbaldehyde
SMILESO=Cc1ccc(NCCO)cn1
InChIInChI=1S/C8H10N2O2/c11-4-3-9-7-1-2-8(6-12)10-5-7/h1-2,5-6,9,11H,3-4H2
InChIKeyGTXGEKBRMRVAPB-UHFFFAOYSA-N
MW166.18 g/mol
LogP0.30
Rot. Bonds4

About 5-(2-hydroxyethylamino)pyridine-2-carbaldehyde

5-(2-hydroxyethylamino)pyridine-2-carbaldehyde (PubChem CID 167016438) has the molecular formula C8H10N2O2 and a molecular weight of 166.18 g/mol. Its IUPAC name is 5-(2-hydroxyethylamino)pyridine-2-carbaldehyde.

Molecular Properties

Compound Name5-(2-hydroxyethylamino)pyridine-2-carbaldehyde
PubChem CID167016438
Molecular FormulaC8H10N2O2
Molecular Weight166.18 g/mol
Exact Mass166.07
IUPAC Name5-(2-hydroxyethylamino)pyridine-2-carbaldehyde
SMILESO=Cc1ccc(NCCO)cn1
InChIInChI=1S/C8H10N2O2/c11-4-3-9-7-1-2-8(6-12)10-5-7/h1-2,5-6,9,11H,3-4H2
InChIKeyGTXGEKBRMRVAPB-UHFFFAOYSA-N
XLogP0.30
TPSA62.22 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.18
LogP ≤ 50.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-[(6-chloro-3-pyridinyl)amino]ethanol
CID 118956304
5-(fluoromethyl)pyridine-2-carbaldehyde
CID 45079502
5-[(2S)-2-amino-1-hydroxypropan-2-yl]pyridine-2-carbaldehyde
CID 55274198
5-[[1-(4-chlorophenyl)cyclopropyl]methylamino]pyridine-2-carbaldehyde
CID 87081081
2-(pyridazin-4-ylamino)ethanol
CID 56983374
5-(3-hydroxypropylamino)pyridine-2-carboxylic acid
CID 115490634
5-(1,1-difluoro-2-hydroxyethoxy)pyridine-2-carbaldehyde;ethane
CID 176709828
[(2E)-2-ethenylpenta-2,4-dienyl] N-(6-formyl-3-pyridinyl)carbamate
CID 144940827
(E)-3-(4-fluorophenyl)-N-[6-(2-hydroxyethylamino)-3-pyridinyl]prop-2-enamide
CID 28903698
2-(4-benzylanilino)ethanol
CID 91561467
1,4-bis[4-(2-hydroxyethylamino)phenyl]butane-1,4-dione
CID 70882599
methyl 3-[(6-formyl-3-pyridinyl)oxy]-2,2-dimethylpropanoate
CID 79794322

Frequently Asked Questions

What is the IUPAC name of 5-(2-hydroxyethylamino)pyridine-2-carbaldehyde?
The IUPAC name of 5-(2-hydroxyethylamino)pyridine-2-carbaldehyde (CID 167016438) is 5-(2-hydroxyethylamino)pyridine-2-carbaldehyde.
What is the SMILES notation for 5-(2-hydroxyethylamino)pyridine-2-carbaldehyde?
The canonical SMILES for 5-(2-hydroxyethylamino)pyridine-2-carbaldehyde is O=Cc1ccc(NCCO)cn1.
What is the InChIKey of 5-(2-hydroxyethylamino)pyridine-2-carbaldehyde?
The InChIKey is GTXGEKBRMRVAPB-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N2O2/c11-4-3-9-7-1-2-8(6-12)10-5-7/h1-2,5-6,9,11H,3-4H2.
What are the key properties of 5-(2-hydroxyethylamino)pyridine-2-carbaldehyde?
5-(2-hydroxyethylamino)pyridine-2-carbaldehyde has a molecular weight of 166.18 g/mol, XLogP of 0.30, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-hydroxyethylamino)pyridine-2-carbaldehyde is sourced from PubChem (CID 167016438), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).