2,3-dihydro-1H-indol-4-ol;hydrochloride

C8H10ClNO — CID 71461077

IUPAC2,3-dihydro-1H-indol-4-ol;hydrochloride
SMILESCl.Oc1cccc2c1CCN2
InChIInChI=1S/C8H9NO.ClH/c10-8-3-1-2-7-6(8)4-5-9-7;/h1-3,9-10H,4-5H2;1H
InChIKeyVHGRKIYYLKCUJJ-UHFFFAOYSA-N
MW171.63 g/mol
LogP1.78
Rot. Bonds

About 2,3-dihydro-1H-indol-4-ol;hydrochloride

2,3-dihydro-1H-indol-4-ol;hydrochloride (PubChem CID 71461077) has the molecular formula C8H10ClNO and a molecular weight of 171.63 g/mol. Its IUPAC name is 2,3-dihydro-1H-indol-4-ol;hydrochloride.

Molecular Properties

Compound Name2,3-dihydro-1H-indol-4-ol;hydrochloride
PubChem CID71461077
Molecular FormulaC8H10ClNO
Molecular Weight171.63 g/mol
Exact Mass171.05
IUPAC Name2,3-dihydro-1H-indol-4-ol;hydrochloride
SMILESCl.Oc1cccc2c1CCN2
InChIInChI=1S/C8H9NO.ClH/c10-8-3-1-2-7-6(8)4-5-9-7;/h1-3,9-10H,4-5H2;1H
InChIKeyVHGRKIYYLKCUJJ-UHFFFAOYSA-N
XLogP1.78
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.63
LogP ≤ 51.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2,3-dihydro-1H-indol-4-ol;hydrochloride?
The IUPAC name of 2,3-dihydro-1H-indol-4-ol;hydrochloride (CID 71461077) is 2,3-dihydro-1H-indol-4-ol;hydrochloride.
What is the SMILES notation for 2,3-dihydro-1H-indol-4-ol;hydrochloride?
The canonical SMILES for 2,3-dihydro-1H-indol-4-ol;hydrochloride is Cl.Oc1cccc2c1CCN2.
What is the InChIKey of 2,3-dihydro-1H-indol-4-ol;hydrochloride?
The InChIKey is VHGRKIYYLKCUJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9NO.ClH/c10-8-3-1-2-7-6(8)4-5-9-7;/h1-3,9-10H,4-5H2;1H.
What are the key properties of 2,3-dihydro-1H-indol-4-ol;hydrochloride?
2,3-dihydro-1H-indol-4-ol;hydrochloride has a molecular weight of 171.63 g/mol, XLogP of 1.78, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dihydro-1H-indol-4-ol;hydrochloride is sourced from PubChem (CID 71461077), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).