2-[[3-(hydroxymethyl)-2-pyridinyl]amino]ethanol

C8H12N2O2 — CID 82341834

IUPAC2-[[3-(hydroxymethyl)-2-pyridinyl]amino]ethanol
SMILESOCCNc1ncccc1CO
InChIInChI=1S/C8H12N2O2/c11-5-4-10-8-7(6-12)2-1-3-9-8/h1-3,11-12H,4-6H2,(H,9,10)
InChIKeyDFECGVLZNFTKQZ-UHFFFAOYSA-N
MW168.20 g/mol
LogP-0.02
Rot. Bonds4

About 2-[[3-(hydroxymethyl)-2-pyridinyl]amino]ethanol

2-[[3-(hydroxymethyl)-2-pyridinyl]amino]ethanol (PubChem CID 82341834) has the molecular formula C8H12N2O2 and a molecular weight of 168.20 g/mol. Its IUPAC name is 2-[[3-(hydroxymethyl)-2-pyridinyl]amino]ethanol.

Molecular Properties

Compound Name2-[[3-(hydroxymethyl)-2-pyridinyl]amino]ethanol
PubChem CID82341834
Molecular FormulaC8H12N2O2
Molecular Weight168.20 g/mol
Exact Mass168.09
IUPAC Name2-[[3-(hydroxymethyl)-2-pyridinyl]amino]ethanol
SMILESOCCNc1ncccc1CO
InChIInChI=1S/C8H12N2O2/c11-5-4-10-8-7(6-12)2-1-3-9-8/h1-3,11-12H,4-6H2,(H,9,10)
InChIKeyDFECGVLZNFTKQZ-UHFFFAOYSA-N
XLogP-0.02
TPSA65.38 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.20
LogP ≤ 5-0.02
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

3-[[3-(hydroxymethyl)-2-pyridinyl]amino]propan-1-ol
CID 82341835
[2-(ethylamino)-3-pyridinyl]methanol
CID 62464975
2-[(3-bromo-2-pyridinyl)amino]ethanol
CID 61374645
[2-(3-butoxypropylamino)-3-pyridinyl]methanol
CID 82341843
[2-(2-hydroxyethylamino)-3-pyridinyl]boronic acid
CID 164518005
[2-[(4-methylphenyl)methylamino]-3-pyridinyl]methanol
CID 82081342
[2-(3,4-dichloroanilino)-3-pyridinyl]methanol
CID 14739451
[2-(3,5-dimethylanilino)-3-pyridinyl]methanol
CID 82081347
2-[propyl-[[2-(propylamino)-3-pyridinyl]methyl]amino]ethanol
CID 62471942
2-[[3-(hydroxymethyl)-2-pyridinyl]amino]butan-1-ol
CID 82341853
N-[3-(hydroxymethyl)-2-pyridinyl]benzamide
CID 82343590
2-[(5-aminoquinolin-8-yl)amino]ethanol
CID 43450143

Frequently Asked Questions

What is the IUPAC name of 2-[[3-(hydroxymethyl)-2-pyridinyl]amino]ethanol?
The IUPAC name of 2-[[3-(hydroxymethyl)-2-pyridinyl]amino]ethanol (CID 82341834) is 2-[[3-(hydroxymethyl)-2-pyridinyl]amino]ethanol.
What is the SMILES notation for 2-[[3-(hydroxymethyl)-2-pyridinyl]amino]ethanol?
The canonical SMILES for 2-[[3-(hydroxymethyl)-2-pyridinyl]amino]ethanol is OCCNc1ncccc1CO.
What is the InChIKey of 2-[[3-(hydroxymethyl)-2-pyridinyl]amino]ethanol?
The InChIKey is DFECGVLZNFTKQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12N2O2/c11-5-4-10-8-7(6-12)2-1-3-9-8/h1-3,11-12H,4-6H2,(H,9,10).
What are the key properties of 2-[[3-(hydroxymethyl)-2-pyridinyl]amino]ethanol?
2-[[3-(hydroxymethyl)-2-pyridinyl]amino]ethanol has a molecular weight of 168.20 g/mol, XLogP of -0.02, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[3-(hydroxymethyl)-2-pyridinyl]amino]ethanol is sourced from PubChem (CID 82341834), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).