2-(aminomethyl)pyridine-3,5-diol

C6H8N2O2 — CID 133058966

IUPAC2-(aminomethyl)pyridine-3,5-diol
SMILESNCc1ncc(O)cc1O
InChIInChI=1S/C6H8N2O2/c7-2-5-6(10)1-4(9)3-8-5/h1,3,9-10H,2,7H2
InChIKeyHCVBXEXVGVGWFW-UHFFFAOYSA-N
MW140.14 g/mol
LogP-0.05
Rot. Bonds1

About 2-(aminomethyl)pyridine-3,5-diol

2-(aminomethyl)pyridine-3,5-diol (PubChem CID 133058966) has the molecular formula C6H8N2O2 and a molecular weight of 140.14 g/mol. Its IUPAC name is 2-(aminomethyl)pyridine-3,5-diol.

Molecular Properties

Compound Name2-(aminomethyl)pyridine-3,5-diol
PubChem CID133058966
Molecular FormulaC6H8N2O2
Molecular Weight140.14 g/mol
Exact Mass140.06
IUPAC Name2-(aminomethyl)pyridine-3,5-diol
SMILESNCc1ncc(O)cc1O
InChIInChI=1S/C6H8N2O2/c7-2-5-6(10)1-4(9)3-8-5/h1,3,9-10H,2,7H2
InChIKeyHCVBXEXVGVGWFW-UHFFFAOYSA-N
XLogP-0.05
TPSA79.37 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500140.14
LogP ≤ 5-0.05
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

2-(aminomethyl)-5-chloropyridin-3-ol
CID 133057163
6-(aminomethyl)-5-bromopyridin-3-ol
CID 133055152
6-(hydroxymethyl)-5-methylpyridin-3-ol;rhodium
CID 58047449
6-(aminomethyl)-5-chloro-4-(difluoromethyl)pyridin-3-ol
CID 118825681
6-amino-2-(aminomethyl)pyridin-3-ol
CID 89291321
5,6-diaminopyridin-3-ol
CID 67350083
5-fluoro-2-(hydroxymethyl)pyridin-3-ol
CID 130850536
(3,5-dibromo-2-pyridinyl)methanamine;hydrochloride
CID 133055680
6-(aminomethyl)-5-fluoropyridin-3-amine
CID 133061809
2-(5-chloro-3-hydroxy-2-pyridinyl)acetamide
CID 133058864
5-[4-(aminomethyl)phenyl]-6-chloropyridin-3-ol
CID 151416184
2-(aminomethyl)-4-(difluoromethyl)-5-hydroxypyridine-3-carbonitrile
CID 118831356

Frequently Asked Questions

What is the IUPAC name of 2-(aminomethyl)pyridine-3,5-diol?
The IUPAC name of 2-(aminomethyl)pyridine-3,5-diol (CID 133058966) is 2-(aminomethyl)pyridine-3,5-diol.
What is the SMILES notation for 2-(aminomethyl)pyridine-3,5-diol?
The canonical SMILES for 2-(aminomethyl)pyridine-3,5-diol is NCc1ncc(O)cc1O.
What is the InChIKey of 2-(aminomethyl)pyridine-3,5-diol?
The InChIKey is HCVBXEXVGVGWFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H8N2O2/c7-2-5-6(10)1-4(9)3-8-5/h1,3,9-10H,2,7H2.
What are the key properties of 2-(aminomethyl)pyridine-3,5-diol?
2-(aminomethyl)pyridine-3,5-diol has a molecular weight of 140.14 g/mol, XLogP of -0.05, 1 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(aminomethyl)pyridine-3,5-diol is sourced from PubChem (CID 133058966), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).