2-amino-1-anilinoimidazol-4-ol

C9H10N4O — CID 69238618

IUPAC2-amino-1-anilinoimidazol-4-ol
SMILESNc1nc(O)cn1Nc1ccccc1
InChIInChI=1S/C9H10N4O/c10-9-11-8(14)6-13(9)12-7-4-2-1-3-5-7/h1-6,12,14H,(H2,10,11)
InChIKeyODGKAJTTYDVPGF-UHFFFAOYSA-N
MW190.21 g/mol
LogP1.05
Rot. Bonds2

About 2-amino-1-anilinoimidazol-4-ol

2-amino-1-anilinoimidazol-4-ol (PubChem CID 69238618) has the molecular formula C9H10N4O and a molecular weight of 190.21 g/mol. Its IUPAC name is 2-amino-1-anilinoimidazol-4-ol.

Molecular Properties

Compound Name2-amino-1-anilinoimidazol-4-ol
PubChem CID69238618
Molecular FormulaC9H10N4O
Molecular Weight190.21 g/mol
Exact Mass190.09
IUPAC Name2-amino-1-anilinoimidazol-4-ol
SMILESNc1nc(O)cn1Nc1ccccc1
InChIInChI=1S/C9H10N4O/c10-9-11-8(14)6-13(9)12-7-4-2-1-3-5-7/h1-6,12,14H,(H2,10,11)
InChIKeyODGKAJTTYDVPGF-UHFFFAOYSA-N
XLogP1.05
TPSA76.10 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.21
LogP ≤ 51.05
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-amino-1-anilinoimidazol-4-ol?
The IUPAC name of 2-amino-1-anilinoimidazol-4-ol (CID 69238618) is 2-amino-1-anilinoimidazol-4-ol.
What is the SMILES notation for 2-amino-1-anilinoimidazol-4-ol?
The canonical SMILES for 2-amino-1-anilinoimidazol-4-ol is Nc1nc(O)cn1Nc1ccccc1.
What is the InChIKey of 2-amino-1-anilinoimidazol-4-ol?
The InChIKey is ODGKAJTTYDVPGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10N4O/c10-9-11-8(14)6-13(9)12-7-4-2-1-3-5-7/h1-6,12,14H,(H2,10,11).
What are the key properties of 2-amino-1-anilinoimidazol-4-ol?
2-amino-1-anilinoimidazol-4-ol has a molecular weight of 190.21 g/mol, XLogP of 1.05, 2 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-1-anilinoimidazol-4-ol is sourced from PubChem (CID 69238618), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).