4-(5-methoxy-1-benzofuran-2-yl)piperidine;hydrochloride

C14H18ClNO2 — CID 23312240

IUPAC4-(5-methoxy-1-benzofuran-2-yl)piperidine;hydrochloride
SMILESCOc1ccc2oc(C3CCNCC3)cc2c1.Cl
InChIInChI=1S/C14H17NO2.ClH/c1-16-12-2-3-13-11(8-12)9-14(17-13)10-4-6-15-7-5-10;/h2-3,8-10,15H,4-7H2,1H3;1H
InChIKeyNOEYHXQJXNOIOQ-UHFFFAOYSA-N
MW267.76 g/mol
LogP3.33
Rot. Bonds2

About 4-(5-methoxy-1-benzofuran-2-yl)piperidine;hydrochloride

4-(5-methoxy-1-benzofuran-2-yl)piperidine;hydrochloride (PubChem CID 23312240) has the molecular formula C14H18ClNO2 and a molecular weight of 267.76 g/mol. Its IUPAC name is 4-(5-methoxy-1-benzofuran-2-yl)piperidine;hydrochloride.

Molecular Properties

Compound Name4-(5-methoxy-1-benzofuran-2-yl)piperidine;hydrochloride
PubChem CID23312240
Molecular FormulaC14H18ClNO2
Molecular Weight267.76 g/mol
Exact Mass267.10
IUPAC Name4-(5-methoxy-1-benzofuran-2-yl)piperidine;hydrochloride
SMILESCOc1ccc2oc(C3CCNCC3)cc2c1.Cl
InChIInChI=1S/C14H17NO2.ClH/c1-16-12-2-3-13-11(8-12)9-14(17-13)10-4-6-15-7-5-10;/h2-3,8-10,15H,4-7H2,1H3;1H
InChIKeyNOEYHXQJXNOIOQ-UHFFFAOYSA-N
XLogP3.33
TPSA34.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.76
LogP ≤ 53.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 4-(5-methoxy-1-benzofuran-2-yl)piperidine;hydrochloride with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4-(5-methoxy-1-benzofuran-2-yl)piperidine;hydrochloride?
The IUPAC name of 4-(5-methoxy-1-benzofuran-2-yl)piperidine;hydrochloride (CID 23312240) is 4-(5-methoxy-1-benzofuran-2-yl)piperidine;hydrochloride.
What is the SMILES notation for 4-(5-methoxy-1-benzofuran-2-yl)piperidine;hydrochloride?
The canonical SMILES for 4-(5-methoxy-1-benzofuran-2-yl)piperidine;hydrochloride is COc1ccc2oc(C3CCNCC3)cc2c1.Cl.
What is the InChIKey of 4-(5-methoxy-1-benzofuran-2-yl)piperidine;hydrochloride?
The InChIKey is NOEYHXQJXNOIOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17NO2.ClH/c1-16-12-2-3-13-11(8-12)9-14(17-13)10-4-6-15-7-5-10;/h2-3,8-10,15H,4-7H2,1H3;1H.
What are the key properties of 4-(5-methoxy-1-benzofuran-2-yl)piperidine;hydrochloride?
4-(5-methoxy-1-benzofuran-2-yl)piperidine;hydrochloride has a molecular weight of 267.76 g/mol, XLogP of 3.33, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(5-methoxy-1-benzofuran-2-yl)piperidine;hydrochloride is sourced from PubChem (CID 23312240), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).