(3E)-3-ethylidene-1,2-dihydroindol-4-ol

C10H11NO — CID 131423207

IUPAC(3E)-3-ethylidene-1,2-dihydroindol-4-ol
SMILESC/C=C1/CNc2cccc(O)c21
InChIInChI=1S/C10H11NO/c1-2-7-6-11-8-4-3-5-9(12)10(7)8/h2-5,11-12H,6H2,1H3/b7-2-
InChIKeyNPSYWJDDZHAXHN-UQCOIBPSSA-N
MW161.20 g/mol
LogP2.22
Rot. Bonds

About (3E)-3-ethylidene-1,2-dihydroindol-4-ol

(3E)-3-ethylidene-1,2-dihydroindol-4-ol (PubChem CID 131423207) has the molecular formula C10H11NO and a molecular weight of 161.20 g/mol. Its IUPAC name is (3E)-3-ethylidene-1,2-dihydroindol-4-ol.

Molecular Properties

Compound Name(3E)-3-ethylidene-1,2-dihydroindol-4-ol
PubChem CID131423207
Molecular FormulaC10H11NO
Molecular Weight161.20 g/mol
Exact Mass161.08
IUPAC Name(3E)-3-ethylidene-1,2-dihydroindol-4-ol
SMILESC/C=C1/CNc2cccc(O)c21
InChIInChI=1S/C10H11NO/c1-2-7-6-11-8-4-3-5-9(12)10(7)8/h2-5,11-12H,6H2,1H3/b7-2-
InChIKeyNPSYWJDDZHAXHN-UQCOIBPSSA-N
XLogP2.22
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500161.20
LogP ≤ 52.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (3E)-3-ethylidene-1,2-dihydroindol-4-ol?
The IUPAC name of (3E)-3-ethylidene-1,2-dihydroindol-4-ol (CID 131423207) is (3E)-3-ethylidene-1,2-dihydroindol-4-ol.
What is the SMILES notation for (3E)-3-ethylidene-1,2-dihydroindol-4-ol?
The canonical SMILES for (3E)-3-ethylidene-1,2-dihydroindol-4-ol is C/C=C1/CNc2cccc(O)c21.
What is the InChIKey of (3E)-3-ethylidene-1,2-dihydroindol-4-ol?
The InChIKey is NPSYWJDDZHAXHN-UQCOIBPSSA-N. The full InChI is InChI=1S/C10H11NO/c1-2-7-6-11-8-4-3-5-9(12)10(7)8/h2-5,11-12H,6H2,1H3/b7-2-.
What are the key properties of (3E)-3-ethylidene-1,2-dihydroindol-4-ol?
(3E)-3-ethylidene-1,2-dihydroindol-4-ol has a molecular weight of 161.20 g/mol, XLogP of 2.22, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3E)-3-ethylidene-1,2-dihydroindol-4-ol is sourced from PubChem (CID 131423207), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).