(E)-3-quinolin-4-ylprop-2-en-1-ol

C12H11NO — CID 22631016

IUPAC(E)-3-quinolin-4-ylprop-2-en-1-ol
SMILESOC/C=C/c1ccnc2ccccc12
InChIInChI=1S/C12H11NO/c14-9-3-4-10-7-8-13-12-6-2-1-5-11(10)12/h1-8,14H,9H2/b4-3+
InChIKeyQZDJRMBGEFDLQR-ONEGZZNKSA-N
MW185.23 g/mol
LogP2.24
Rot. Bonds2

About (E)-3-quinolin-4-ylprop-2-en-1-ol

(E)-3-quinolin-4-ylprop-2-en-1-ol (PubChem CID 22631016) has the molecular formula C12H11NO and a molecular weight of 185.23 g/mol. Its IUPAC name is (E)-3-quinolin-4-ylprop-2-en-1-ol.

Molecular Properties

Compound Name(E)-3-quinolin-4-ylprop-2-en-1-ol
PubChem CID22631016
Molecular FormulaC12H11NO
Molecular Weight185.23 g/mol
Exact Mass185.08
IUPAC Name(E)-3-quinolin-4-ylprop-2-en-1-ol
SMILESOC/C=C/c1ccnc2ccccc12
InChIInChI=1S/C12H11NO/c14-9-3-4-10-7-8-13-12-6-2-1-5-11(10)12/h1-8,14H,9H2/b4-3+
InChIKeyQZDJRMBGEFDLQR-ONEGZZNKSA-N
XLogP2.24
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.23
LogP ≤ 52.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (E)-3-quinolin-4-ylprop-2-en-1-ol?
The IUPAC name of (E)-3-quinolin-4-ylprop-2-en-1-ol (CID 22631016) is (E)-3-quinolin-4-ylprop-2-en-1-ol.
What is the SMILES notation for (E)-3-quinolin-4-ylprop-2-en-1-ol?
The canonical SMILES for (E)-3-quinolin-4-ylprop-2-en-1-ol is OC/C=C/c1ccnc2ccccc12.
What is the InChIKey of (E)-3-quinolin-4-ylprop-2-en-1-ol?
The InChIKey is QZDJRMBGEFDLQR-ONEGZZNKSA-N. The full InChI is InChI=1S/C12H11NO/c14-9-3-4-10-7-8-13-12-6-2-1-5-11(10)12/h1-8,14H,9H2/b4-3+.
What are the key properties of (E)-3-quinolin-4-ylprop-2-en-1-ol?
(E)-3-quinolin-4-ylprop-2-en-1-ol has a molecular weight of 185.23 g/mol, XLogP of 2.24, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-3-quinolin-4-ylprop-2-en-1-ol is sourced from PubChem (CID 22631016), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).