4,6-diaminopyridin-3-ol

C5H7N3O — CID 133056691

IUPAC4,6-diaminopyridin-3-ol
SMILESNc1cc(N)c(O)cn1
InChIInChI=1S/C5H7N3O/c6-3-1-5(7)8-2-4(3)9/h1-2,9H,(H4,6,7,8)
InChIKeySJMXSXRTOIGRLL-UHFFFAOYSA-N
MW125.13 g/mol
LogP-0.05
Rot. Bonds

About 4,6-diaminopyridin-3-ol

4,6-diaminopyridin-3-ol (PubChem CID 133056691) has the molecular formula C5H7N3O and a molecular weight of 125.13 g/mol. Its IUPAC name is 4,6-diaminopyridin-3-ol.

Molecular Properties

Compound Name4,6-diaminopyridin-3-ol
PubChem CID133056691
Molecular FormulaC5H7N3O
Molecular Weight125.13 g/mol
Exact Mass125.06
IUPAC Name4,6-diaminopyridin-3-ol
SMILESNc1cc(N)c(O)cn1
InChIInChI=1S/C5H7N3O/c6-3-1-5(7)8-2-4(3)9/h1-2,9H,(H4,6,7,8)
InChIKeySJMXSXRTOIGRLL-UHFFFAOYSA-N
XLogP-0.05
TPSA85.16 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500125.13
LogP ≤ 5-0.05
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

4-amino-6-chloropyridin-3-ol
CID 45079903
4-amino-6-(hydroxymethyl)pyridin-3-ol
CID 171035977
2,6-naphthyridine-3,7-diamine
CID 141099373
2-amino-5-hydroxypyridine-4-carbonitrile
CID 119023533
6-amino-4-methoxypyridin-3-ol
CID 175559465
2,5-diaminobenzene-1,4-diol;dihydrobromide
CID 70601230
5-N-chloropyridine-2,4,5-triamine
CID 87287870
5-propylpyridine-2,4-diamine
CID 57315909
5-phenylpyridine-2,4-diamine
CID 118999182
4-amino-6-phenylmethoxypyridin-3-ol;hydrochloride
CID 86731412
2-(2-amino-5-chloro-4-pyridinyl)phenol
CID 139543768
1H-pyrrolo[2,3-c]pyridin-5-amine;dihydrochloride
CID 67382254

Frequently Asked Questions

What is the IUPAC name of 4,6-diaminopyridin-3-ol?
The IUPAC name of 4,6-diaminopyridin-3-ol (CID 133056691) is 4,6-diaminopyridin-3-ol.
What is the SMILES notation for 4,6-diaminopyridin-3-ol?
The canonical SMILES for 4,6-diaminopyridin-3-ol is Nc1cc(N)c(O)cn1.
What is the InChIKey of 4,6-diaminopyridin-3-ol?
The InChIKey is SJMXSXRTOIGRLL-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H7N3O/c6-3-1-5(7)8-2-4(3)9/h1-2,9H,(H4,6,7,8).
What are the key properties of 4,6-diaminopyridin-3-ol?
4,6-diaminopyridin-3-ol has a molecular weight of 125.13 g/mol, XLogP of -0.05, 0 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4,6-diaminopyridin-3-ol is sourced from PubChem (CID 133056691), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).