4-aminopyridin-3-ol;dihydrochloride

C5H8Cl2N2O — CID 127255436

IUPAC4-aminopyridin-3-ol;dihydrochloride
SMILESCl.Cl.Nc1ccncc1O
InChIInChI=1S/C5H6N2O.2ClH/c6-4-1-2-7-3-5(4)8;;/h1-3,8H,(H2,6,7);2*1H
InChIKeyIMMJEWSHPROHBK-UHFFFAOYSA-N
MW183.04 g/mol
LogP1.21
Rot. Bonds

About 4-aminopyridin-3-ol;dihydrochloride

4-aminopyridin-3-ol;dihydrochloride (PubChem CID 127255436) has the molecular formula C5H8Cl2N2O and a molecular weight of 183.04 g/mol. Its IUPAC name is 4-aminopyridin-3-ol;dihydrochloride.

Molecular Properties

Compound Name4-aminopyridin-3-ol;dihydrochloride
PubChem CID127255436
Molecular FormulaC5H8Cl2N2O
Molecular Weight183.04 g/mol
Exact Mass182.00
IUPAC Name4-aminopyridin-3-ol;dihydrochloride
SMILESCl.Cl.Nc1ccncc1O
InChIInChI=1S/C5H6N2O.2ClH/c6-4-1-2-7-3-5(4)8;;/h1-3,8H,(H2,6,7);2*1H
InChIKeyIMMJEWSHPROHBK-UHFFFAOYSA-N
XLogP1.21
TPSA59.14 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.04
LogP ≤ 51.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-fluoropyridin-3-ol;hydrochloride
CID 86717938
4-(aminomethyl)pyridin-3-ol
CID 15850356
4-aminopyridine-3-thiol
CID 14062661
8-aminoisoquinolin-7-ol;hydrochloride
CID 67670050
ethane;molecular hydrogen;pyridine-3,4-diamine
CID 143900144
isoquinoline-5,8-diamine;hydrochloride
CID 75525603
4-methylpyridin-3-ol;trihydrobromide
CID 174838364
4-aminopyridine-3,5-diol
CID 53421074
3-(bromomethyl)pyridin-4-amine
CID 18674607
4-(trifluoromethyl)pyridin-3-ol
CID 25210497
N-(4-amino-3-pyridinyl)acetamide
CID 11593462
2-amino-2-(3-hydroxy-4-pyridinyl)acetic acid
CID 55293514

Frequently Asked Questions

What is the IUPAC name of 4-aminopyridin-3-ol;dihydrochloride?
The IUPAC name of 4-aminopyridin-3-ol;dihydrochloride (CID 127255436) is 4-aminopyridin-3-ol;dihydrochloride.
What is the SMILES notation for 4-aminopyridin-3-ol;dihydrochloride?
The canonical SMILES for 4-aminopyridin-3-ol;dihydrochloride is Cl.Cl.Nc1ccncc1O.
What is the InChIKey of 4-aminopyridin-3-ol;dihydrochloride?
The InChIKey is IMMJEWSHPROHBK-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H6N2O.2ClH/c6-4-1-2-7-3-5(4)8;;/h1-3,8H,(H2,6,7);2*1H.
What are the key properties of 4-aminopyridin-3-ol;dihydrochloride?
4-aminopyridin-3-ol;dihydrochloride has a molecular weight of 183.04 g/mol, XLogP of 1.21, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-aminopyridin-3-ol;dihydrochloride is sourced from PubChem (CID 127255436), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).