2-(5,6-dimethyl-1-benzofuran-3-yl)-N-piperidin-4-ylacetamide;hydrochloride

C17H23ClN2O2 — CID 119386294

IUPAC2-(5,6-dimethyl-1-benzofuran-3-yl)-N-piperidin-4-ylacetamide;hydrochloride
SMILESCc1cc2occ(CC(=O)NC3CCNCC3)c2cc1C.Cl
InChIInChI=1S/C17H22N2O2.ClH/c1-11-7-15-13(10-21-16(15)8-12(11)2)9-17(20)19-14-3-5-18-6-4-14;/h7-8,10,14,18H,3-6,9H2,1-2H3,(H,19,20);1H
InChIKeyLCGJAVUJWLWDIQ-UHFFFAOYSA-N
MW322.84 g/mol
LogP2.88
Rot. Bonds3

About 2-(5,6-dimethyl-1-benzofuran-3-yl)-N-piperidin-4-ylacetamide;hydrochloride

2-(5,6-dimethyl-1-benzofuran-3-yl)-N-piperidin-4-ylacetamide;hydrochloride (PubChem CID 119386294) has the molecular formula C17H23ClN2O2 and a molecular weight of 322.84 g/mol. Its IUPAC name is 2-(5,6-dimethyl-1-benzofuran-3-yl)-N-piperidin-4-ylacetamide;hydrochloride.

Molecular Properties

Compound Name2-(5,6-dimethyl-1-benzofuran-3-yl)-N-piperidin-4-ylacetamide;hydrochloride
PubChem CID119386294
Molecular FormulaC17H23ClN2O2
Molecular Weight322.84 g/mol
Exact Mass322.14
IUPAC Name2-(5,6-dimethyl-1-benzofuran-3-yl)-N-piperidin-4-ylacetamide;hydrochloride
SMILESCc1cc2occ(CC(=O)NC3CCNCC3)c2cc1C.Cl
InChIInChI=1S/C17H22N2O2.ClH/c1-11-7-15-13(10-21-16(15)8-12(11)2)9-17(20)19-14-3-5-18-6-4-14;/h7-8,10,14,18H,3-6,9H2,1-2H3,(H,19,20);1H
InChIKeyLCGJAVUJWLWDIQ-UHFFFAOYSA-N
XLogP2.88
TPSA54.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.84
LogP ≤ 52.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-aminocyclohexyl)-2-(5,6-dimethyl-1-benzofuran-3-yl)acetamide;hydrochloride
CID 119474919
2-(6-methyl-5-propan-2-yl-1-benzofuran-3-yl)-N-piperidin-3-ylacetamide
CID 119424316
2-(6-methoxy-1-benzofuran-3-yl)-N-pyrrolidin-3-ylacetamide;hydrochloride
CID 119452018
2-(5,6-dimethyl-1-benzofuran-3-yl)-N-methyl-N-pyrrolidin-3-ylacetamide
CID 119550456
N-[1-(4-acetamidophenyl)sulfonylpiperidin-4-yl]-2-(5,6-dimethyl-1-benzofuran-3-yl)acetamide
CID 41368529
2-(5,6-dimethyl-1-benzofuran-3-yl)-N-[(6R)-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]acetamide
CID 95137075
N-(3-methylpiperidin-4-yl)-2-(6-methyl-5-propan-2-yl-1-benzofuran-3-yl)acetamide
CID 120557695
2-(2,5-dimethylphenyl)-N-piperidin-4-ylacetamide
CID 62537679
[(2R)-1-(cyclohexylamino)-1-oxopropan-2-yl] 2-(5,6-dimethyl-1-benzofuran-3-yl)acetate
CID 7251900
2-(5,6-dimethyl-1-benzofuran-3-yl)-N-(4-fluorophenyl)acetamide
CID 7733151
2-(5,6-dimethyl-1-benzofuran-3-yl)-N-(3,4-dimethylphenyl)acetamide
CID 16547774
N-[2-[[2-(5,6-dimethyl-1-benzofuran-3-yl)acetyl]amino]ethyl]-2-methylpropanamide
CID 35518370

Frequently Asked Questions

What is the IUPAC name of 2-(5,6-dimethyl-1-benzofuran-3-yl)-N-piperidin-4-ylacetamide;hydrochloride?
The IUPAC name of 2-(5,6-dimethyl-1-benzofuran-3-yl)-N-piperidin-4-ylacetamide;hydrochloride (CID 119386294) is 2-(5,6-dimethyl-1-benzofuran-3-yl)-N-piperidin-4-ylacetamide;hydrochloride.
What is the SMILES notation for 2-(5,6-dimethyl-1-benzofuran-3-yl)-N-piperidin-4-ylacetamide;hydrochloride?
The canonical SMILES for 2-(5,6-dimethyl-1-benzofuran-3-yl)-N-piperidin-4-ylacetamide;hydrochloride is Cc1cc2occ(CC(=O)NC3CCNCC3)c2cc1C.Cl.
What is the InChIKey of 2-(5,6-dimethyl-1-benzofuran-3-yl)-N-piperidin-4-ylacetamide;hydrochloride?
The InChIKey is LCGJAVUJWLWDIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N2O2.ClH/c1-11-7-15-13(10-21-16(15)8-12(11)2)9-17(20)19-14-3-5-18-6-4-14;/h7-8,10,14,18H,3-6,9H2,1-2H3,(H,19,20);1H.
What are the key properties of 2-(5,6-dimethyl-1-benzofuran-3-yl)-N-piperidin-4-ylacetamide;hydrochloride?
2-(5,6-dimethyl-1-benzofuran-3-yl)-N-piperidin-4-ylacetamide;hydrochloride has a molecular weight of 322.84 g/mol, XLogP of 2.88, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5,6-dimethyl-1-benzofuran-3-yl)-N-piperidin-4-ylacetamide;hydrochloride is sourced from PubChem (CID 119386294), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).