6-(1-chloroethyl)-2,3-dihydrofuro[2,3-b]pyridine

C9H10ClNO — CID 146287035

IUPAC6-(1-chloroethyl)-2,3-dihydrofuro[2,3-b]pyridine
SMILESCC(Cl)c1ccc2c(n1)OCC2
InChIInChI=1S/C9H10ClNO/c1-6(10)8-3-2-7-4-5-12-9(7)11-8/h2-3,6H,4-5H2,1H3
InChIKeyGTQLBBISDJKKQC-UHFFFAOYSA-N
MW183.64 g/mol
LogP2.32
Rot. Bonds1

About 6-(1-chloroethyl)-2,3-dihydrofuro[2,3-b]pyridine

6-(1-chloroethyl)-2,3-dihydrofuro[2,3-b]pyridine (PubChem CID 146287035) has the molecular formula C9H10ClNO and a molecular weight of 183.64 g/mol. Its IUPAC name is 6-(1-chloroethyl)-2,3-dihydrofuro[2,3-b]pyridine.

Molecular Properties

Compound Name6-(1-chloroethyl)-2,3-dihydrofuro[2,3-b]pyridine
PubChem CID146287035
Molecular FormulaC9H10ClNO
Molecular Weight183.64 g/mol
Exact Mass183.05
IUPAC Name6-(1-chloroethyl)-2,3-dihydrofuro[2,3-b]pyridine
SMILESCC(Cl)c1ccc2c(n1)OCC2
InChIInChI=1S/C9H10ClNO/c1-6(10)8-3-2-7-4-5-12-9(7)11-8/h2-3,6H,4-5H2,1H3
InChIKeyGTQLBBISDJKKQC-UHFFFAOYSA-N
XLogP2.32
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.64
LogP ≤ 52.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'alkyl_halide', 'substructure': 'N/A'}

Analyze 6-(1-chloroethyl)-2,3-dihydrofuro[2,3-b]pyridine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

7-propan-2-yl-3,4-dihydro-2H-pyrano[2,3-b]pyridine
CID 118504510
2-fluoropropan-1-ol;methylsulfanylmethane;6-(trifluoromethyl)-2,3-dihydrofuro[2,3-b]pyridine
CID 177207182
8-methyl-2,3-dihydrofuro[2,3-b]quinoline
CID 603941
ethane;3-methyl-5,6-dihydrofuro[2,3-c]pyridazine
CID 145497461
2-(1-chloroethyl)quinoline
CID 14750485
1-(2,3-dihydro-1-benzofuran-6-yl)ethanamine;hydrochloride
CID 91758963
7-(1-chloroethyl)-2,3-dihydro-[1,4]dioxino[2,3-b]pyridine
CID 146283740
5-[(E)-3-chlorobut-1-enyl]-2,3-dihydro-1-benzofuran
CID 130539002
6-ethyl-2,3-dihydro-1-benzofuran
CID 59981216
5-propan-2-yl-2,3-dihydro-1-benzofuran;6-propan-2-yl-2,3-dihydro-1-benzofuran
CID 158005969
2-(2,3-dihydro-1-benzofuran-5-yl)-4-propan-2-yl-1,3-thiazole
CID 58689212
6-tert-butyl-2,3-dihydrofuro[2,3-b]pyridine-5-carboxylic acid
CID 83822535

Frequently Asked Questions

What is the IUPAC name of 6-(1-chloroethyl)-2,3-dihydrofuro[2,3-b]pyridine?
The IUPAC name of 6-(1-chloroethyl)-2,3-dihydrofuro[2,3-b]pyridine (CID 146287035) is 6-(1-chloroethyl)-2,3-dihydrofuro[2,3-b]pyridine.
What is the SMILES notation for 6-(1-chloroethyl)-2,3-dihydrofuro[2,3-b]pyridine?
The canonical SMILES for 6-(1-chloroethyl)-2,3-dihydrofuro[2,3-b]pyridine is CC(Cl)c1ccc2c(n1)OCC2.
What is the InChIKey of 6-(1-chloroethyl)-2,3-dihydrofuro[2,3-b]pyridine?
The InChIKey is GTQLBBISDJKKQC-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10ClNO/c1-6(10)8-3-2-7-4-5-12-9(7)11-8/h2-3,6H,4-5H2,1H3.
What are the key properties of 6-(1-chloroethyl)-2,3-dihydrofuro[2,3-b]pyridine?
6-(1-chloroethyl)-2,3-dihydrofuro[2,3-b]pyridine has a molecular weight of 183.64 g/mol, XLogP of 2.32, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(1-chloroethyl)-2,3-dihydrofuro[2,3-b]pyridine is sourced from PubChem (CID 146287035), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).