1-amino-2-iminopyridin-3-ol

C5H7N3O — CID 45078736

IUPAC1-amino-2-iminopyridin-3-ol
SMILES[H]/N=c1\c(O)cccn1N
InChIInChI=1S/C5H7N3O/c6-5-4(9)2-1-3-8(5)7/h1-3,6,9H,7H2/b6-5+
InChIKeyOVWPSYNFMWCTLA-AATRIKPKSA-N
MW125.13 g/mol
LogP-0.61
Rot. Bonds

About 1-amino-2-iminopyridin-3-ol

1-amino-2-iminopyridin-3-ol (PubChem CID 45078736) has the molecular formula C5H7N3O and a molecular weight of 125.13 g/mol. Its IUPAC name is 1-amino-2-iminopyridin-3-ol.

Molecular Properties

Compound Name1-amino-2-iminopyridin-3-ol
PubChem CID45078736
Molecular FormulaC5H7N3O
Molecular Weight125.13 g/mol
Exact Mass125.06
IUPAC Name1-amino-2-iminopyridin-3-ol
SMILES[H]/N=c1\c(O)cccn1N
InChIInChI=1S/C5H7N3O/c6-5-4(9)2-1-3-8(5)7/h1-3,6,9H,7H2/b6-5+
InChIKeyOVWPSYNFMWCTLA-AATRIKPKSA-N
XLogP-0.61
TPSA75.03 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 ≤ 5-0.61
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-amino-2-iminopyridin-3-ol?
The IUPAC name of 1-amino-2-iminopyridin-3-ol (CID 45078736) is 1-amino-2-iminopyridin-3-ol.
What is the SMILES notation for 1-amino-2-iminopyridin-3-ol?
The canonical SMILES for 1-amino-2-iminopyridin-3-ol is [H]/N=c1\c(O)cccn1N.
What is the InChIKey of 1-amino-2-iminopyridin-3-ol?
The InChIKey is OVWPSYNFMWCTLA-AATRIKPKSA-N. The full InChI is InChI=1S/C5H7N3O/c6-5-4(9)2-1-3-8(5)7/h1-3,6,9H,7H2/b6-5+.
What are the key properties of 1-amino-2-iminopyridin-3-ol?
1-amino-2-iminopyridin-3-ol has a molecular weight of 125.13 g/mol, XLogP of -0.61, 0 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-2-iminopyridin-3-ol is sourced from PubChem (CID 45078736), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).