[1-(4-aminophenyl)imidazol-2-yl]methanol

C10H11N3O — CID 59577798

IUPAC[1-(4-aminophenyl)imidazol-2-yl]methanol
SMILESNc1ccc(-n2ccnc2CO)cc1
InChIInChI=1S/C10H11N3O/c11-8-1-3-9(4-2-8)13-6-5-12-10(13)7-14/h1-6,14H,7,11H2
InChIKeyWNFNISXOGLNDCF-UHFFFAOYSA-N
MW189.22 g/mol
LogP0.95
Rot. Bonds2

About [1-(4-aminophenyl)imidazol-2-yl]methanol

[1-(4-aminophenyl)imidazol-2-yl]methanol (PubChem CID 59577798) has the molecular formula C10H11N3O and a molecular weight of 189.22 g/mol. Its IUPAC name is [1-(4-aminophenyl)imidazol-2-yl]methanol.

Molecular Properties

Compound Name[1-(4-aminophenyl)imidazol-2-yl]methanol
PubChem CID59577798
Molecular FormulaC10H11N3O
Molecular Weight189.22 g/mol
Exact Mass189.09
IUPAC Name[1-(4-aminophenyl)imidazol-2-yl]methanol
SMILESNc1ccc(-n2ccnc2CO)cc1
InChIInChI=1S/C10H11N3O/c11-8-1-3-9(4-2-8)13-6-5-12-10(13)7-14/h1-6,14H,7,11H2
InChIKeyWNFNISXOGLNDCF-UHFFFAOYSA-N
XLogP0.95
TPSA64.07 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.22
LogP ≤ 50.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_no_alk(40)', 'substructure': 'N/A'}, {'alert_name': 'aniline', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of [1-(4-aminophenyl)imidazol-2-yl]methanol?
The IUPAC name of [1-(4-aminophenyl)imidazol-2-yl]methanol (CID 59577798) is [1-(4-aminophenyl)imidazol-2-yl]methanol.
What is the SMILES notation for [1-(4-aminophenyl)imidazol-2-yl]methanol?
The canonical SMILES for [1-(4-aminophenyl)imidazol-2-yl]methanol is Nc1ccc(-n2ccnc2CO)cc1.
What is the InChIKey of [1-(4-aminophenyl)imidazol-2-yl]methanol?
The InChIKey is WNFNISXOGLNDCF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11N3O/c11-8-1-3-9(4-2-8)13-6-5-12-10(13)7-14/h1-6,14H,7,11H2.
What are the key properties of [1-(4-aminophenyl)imidazol-2-yl]methanol?
[1-(4-aminophenyl)imidazol-2-yl]methanol has a molecular weight of 189.22 g/mol, XLogP of 0.95, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(4-aminophenyl)imidazol-2-yl]methanol is sourced from PubChem (CID 59577798), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).