N-[1-[2-(2,3-dihydro-1-benzofuran-5-yl)ethyl]piperidin-3-yl]acetamide

C17H24N2O2 — CID 171130329

IUPACN-[1-[2-(2,3-dihydro-1-benzofuran-5-yl)ethyl]piperidin-3-yl]acetamide
SMILESCC(=O)NC1CCCN(CCc2ccc3c(c2)CCO3)C1
InChIInChI=1S/C17H24N2O2/c1-13(20)18-16-3-2-8-19(12-16)9-6-14-4-5-17-15(11-14)7-10-21-17/h4-5,11,16H,2-3,6-10,12H2,1H3,(H,18,20)
InChIKeyHSYJWOFICACFEK-UHFFFAOYSA-N
MW288.39 g/mol
LogP1.76
Rot. Bonds4

About N-[1-[2-(2,3-dihydro-1-benzofuran-5-yl)ethyl]piperidin-3-yl]acetamide

N-[1-[2-(2,3-dihydro-1-benzofuran-5-yl)ethyl]piperidin-3-yl]acetamide (PubChem CID 171130329) has the molecular formula C17H24N2O2 and a molecular weight of 288.39 g/mol. Its IUPAC name is N-[1-[2-(2,3-dihydro-1-benzofuran-5-yl)ethyl]piperidin-3-yl]acetamide.

Molecular Properties

Compound NameN-[1-[2-(2,3-dihydro-1-benzofuran-5-yl)ethyl]piperidin-3-yl]acetamide
PubChem CID171130329
Molecular FormulaC17H24N2O2
Molecular Weight288.39 g/mol
Exact Mass288.18
IUPAC NameN-[1-[2-(2,3-dihydro-1-benzofuran-5-yl)ethyl]piperidin-3-yl]acetamide
SMILESCC(=O)NC1CCCN(CCc2ccc3c(c2)CCO3)C1
InChIInChI=1S/C17H24N2O2/c1-13(20)18-16-3-2-8-19(12-16)9-6-14-4-5-17-15(11-14)7-10-21-17/h4-5,11,16H,2-3,6-10,12H2,1H3,(H,18,20)
InChIKeyHSYJWOFICACFEK-UHFFFAOYSA-N
XLogP1.76
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.39
LogP ≤ 51.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[1-[2-(2,3-dihydro-1-benzofuran-5-yl)ethyl]piperidin-3-yl]-N-methylmorpholine-4-carboxamide
CID 172892101
(3R)-1-[2-(2,3-dihydro-1-benzofuran-5-yl)ethyl]pyrrolidin-3-ol
CID 46220656
1-[4-[2-(2,3-dihydro-1-benzofuran-5-yl)ethyl]piperazin-1-yl]ethanone
CID 163350132
[1-[2-(2,3-dihydro-1-benzofuran-5-yl)ethyl]piperidin-3-yl]methanamine;hydrochloride
CID 119915626
tert-butyl N-[1-[2-(2,3-dihydro-1-benzofuran-5-yl)ethyl]piperidin-4-yl]carbamate
CID 71987002
3-cyclopropyl-1-[2-(2,3-dihydro-1-benzofuran-5-yl)ethyl]pyrrolidine
CID 154807715
4-chloro-1-[2-(2,3-dihydro-1-benzofuran-5-yl)ethyl]piperidine
CID 65445385
2-[1-[2-(2,3-dihydro-1-benzofuran-5-yl)ethyl]pyrrolidin-3-yl]ethanol
CID 115665607
2-[1-[2-(2,3-dihydro-1-benzofuran-5-yl)ethyl]azepan-4-yl]-2,2-diphenylacetamide
CID 142809097
N-(1-benzylpiperidin-3-yl)-3-(2,3-dihydro-1-benzofuran-5-yl)prop-2-enamide
CID 55645166
1-[2-(2,3-dihydro-1-benzofuran-5-yl)ethyl]-3-phenylpyrrolidine
CID 173048470
N-[1-(3-phenylpropyl)piperidin-3-yl]acetamide
CID 171328429

Frequently Asked Questions

What is the IUPAC name of N-[1-[2-(2,3-dihydro-1-benzofuran-5-yl)ethyl]piperidin-3-yl]acetamide?
The IUPAC name of N-[1-[2-(2,3-dihydro-1-benzofuran-5-yl)ethyl]piperidin-3-yl]acetamide (CID 171130329) is N-[1-[2-(2,3-dihydro-1-benzofuran-5-yl)ethyl]piperidin-3-yl]acetamide.
What is the SMILES notation for N-[1-[2-(2,3-dihydro-1-benzofuran-5-yl)ethyl]piperidin-3-yl]acetamide?
The canonical SMILES for N-[1-[2-(2,3-dihydro-1-benzofuran-5-yl)ethyl]piperidin-3-yl]acetamide is CC(=O)NC1CCCN(CCc2ccc3c(c2)CCO3)C1.
What is the InChIKey of N-[1-[2-(2,3-dihydro-1-benzofuran-5-yl)ethyl]piperidin-3-yl]acetamide?
The InChIKey is HSYJWOFICACFEK-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N2O2/c1-13(20)18-16-3-2-8-19(12-16)9-6-14-4-5-17-15(11-14)7-10-21-17/h4-5,11,16H,2-3,6-10,12H2,1H3,(H,18,20).
What are the key properties of N-[1-[2-(2,3-dihydro-1-benzofuran-5-yl)ethyl]piperidin-3-yl]acetamide?
N-[1-[2-(2,3-dihydro-1-benzofuran-5-yl)ethyl]piperidin-3-yl]acetamide has a molecular weight of 288.39 g/mol, XLogP of 1.76, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-[2-(2,3-dihydro-1-benzofuran-5-yl)ethyl]piperidin-3-yl]acetamide is sourced from PubChem (CID 171130329), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).