[4-(1-aminoethenyl)phenyl]methanol

C9H11NO — CID 89070101

IUPAC[4-(1-aminoethenyl)phenyl]methanol
SMILESC=C(N)c1ccc(CO)cc1
InChIInChI=1S/C9H11NO/c1-7(10)9-4-2-8(6-11)3-5-9/h2-5,11H,1,6,10H2
InChIKeyMIILKXMNQLUJOZ-UHFFFAOYSA-N
MW149.19 g/mol
LogP1.11
Rot. Bonds2

About [4-(1-aminoethenyl)phenyl]methanol

[4-(1-aminoethenyl)phenyl]methanol (PubChem CID 89070101) has the molecular formula C9H11NO and a molecular weight of 149.19 g/mol. Its IUPAC name is [4-(1-aminoethenyl)phenyl]methanol.

Molecular Properties

Compound Name[4-(1-aminoethenyl)phenyl]methanol
PubChem CID89070101
Molecular FormulaC9H11NO
Molecular Weight149.19 g/mol
Exact Mass149.08
IUPAC Name[4-(1-aminoethenyl)phenyl]methanol
SMILESC=C(N)c1ccc(CO)cc1
InChIInChI=1S/C9H11NO/c1-7(10)9-4-2-8(6-11)3-5-9/h2-5,11H,1,6,10H2
InChIKeyMIILKXMNQLUJOZ-UHFFFAOYSA-N
XLogP1.11
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500149.19
LogP ≤ 51.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of [4-(1-aminoethenyl)phenyl]methanol?
The IUPAC name of [4-(1-aminoethenyl)phenyl]methanol (CID 89070101) is [4-(1-aminoethenyl)phenyl]methanol.
What is the SMILES notation for [4-(1-aminoethenyl)phenyl]methanol?
The canonical SMILES for [4-(1-aminoethenyl)phenyl]methanol is C=C(N)c1ccc(CO)cc1.
What is the InChIKey of [4-(1-aminoethenyl)phenyl]methanol?
The InChIKey is MIILKXMNQLUJOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11NO/c1-7(10)9-4-2-8(6-11)3-5-9/h2-5,11H,1,6,10H2.
What are the key properties of [4-(1-aminoethenyl)phenyl]methanol?
[4-(1-aminoethenyl)phenyl]methanol has a molecular weight of 149.19 g/mol, XLogP of 1.11, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(1-aminoethenyl)phenyl]methanol is sourced from PubChem (CID 89070101), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).