2-(2,3-dihydro-1-benzofuran-5-yl)-2-piperazin-1-ylacetamide

C14H19N3O2 — CID 54892195

IUPAC2-(2,3-dihydro-1-benzofuran-5-yl)-2-piperazin-1-ylacetamide
SMILESNC(=O)C(c1ccc2c(c1)CCO2)N1CCNCC1
InChIInChI=1S/C14H19N3O2/c15-14(18)13(17-6-4-16-5-7-17)11-1-2-12-10(9-11)3-8-19-12/h1-2,9,13,16H,3-8H2,(H2,15,18)
InChIKeyPMENFDDDPNXCGI-UHFFFAOYSA-N
MW261.32 g/mol
LogP0.05
Rot. Bonds3

About 2-(2,3-dihydro-1-benzofuran-5-yl)-2-piperazin-1-ylacetamide

2-(2,3-dihydro-1-benzofuran-5-yl)-2-piperazin-1-ylacetamide (PubChem CID 54892195) has the molecular formula C14H19N3O2 and a molecular weight of 261.32 g/mol. Its IUPAC name is 2-(2,3-dihydro-1-benzofuran-5-yl)-2-piperazin-1-ylacetamide.

Molecular Properties

Compound Name2-(2,3-dihydro-1-benzofuran-5-yl)-2-piperazin-1-ylacetamide
PubChem CID54892195
Molecular FormulaC14H19N3O2
Molecular Weight261.32 g/mol
Exact Mass261.15
IUPAC Name2-(2,3-dihydro-1-benzofuran-5-yl)-2-piperazin-1-ylacetamide
SMILESNC(=O)C(c1ccc2c(c1)CCO2)N1CCNCC1
InChIInChI=1S/C14H19N3O2/c15-14(18)13(17-6-4-16-5-7-17)11-1-2-12-10(9-11)3-8-19-12/h1-2,9,13,16H,3-8H2,(H2,15,18)
InChIKeyPMENFDDDPNXCGI-UHFFFAOYSA-N
XLogP0.05
TPSA67.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.32
LogP ≤ 50.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-[(1R)-1-(2,3-dihydro-1-benzofuran-5-yl)ethyl]piperazine
CID 96840191
1-[(1S)-1-(2,3-dihydro-1-benzofuran-5-yl)-2-fluoroethyl]piperazine
CID 171181795
1-(2,3-dihydro-1-benzofuran-5-yl)-N-methyl-1-piperazin-1-ylmethanamine
CID 116954841
2-(3,4-dihydroxyphenyl)-2-piperazin-1-ylacetamide
CID 54892096
1-[(1S)-1-(2,3-dihydro-1-benzofuran-5-yl)propyl]piperazine;dihydrochloride
CID 171275729
2-(2,3-dihydro-1-benzofuran-5-yl)-2-hydroxyacetamide
CID 62225836
(2R)-2-phenyl-2-piperazin-1-ylacetamide
CID 28805503
1-[(S)-cyclopentyl(2,3-dihydro-1-benzofuran-5-yl)methyl]piperazine;dihydrochloride
CID 171275740
1-[(1R)-1-(2,3-dihydro-1-benzofuran-5-yl)-2-methylbutyl]piperazine
CID 171304422
1-[(R)-2,3-dihydro-1-benzofuran-5-yl(oxan-4-yl)methyl]piperazine;dihydrochloride
CID 171288374
2-(3,4-dihydro-2H-chromen-6-yl)-2-pyrrolidin-1-ylacetic acid
CID 82485168
1-(2,3-dihydro-1-benzofuran-5-yl)-3-piperazin-1-ylpropan-1-amine
CID 116939919

Frequently Asked Questions

What is the IUPAC name of 2-(2,3-dihydro-1-benzofuran-5-yl)-2-piperazin-1-ylacetamide?
The IUPAC name of 2-(2,3-dihydro-1-benzofuran-5-yl)-2-piperazin-1-ylacetamide (CID 54892195) is 2-(2,3-dihydro-1-benzofuran-5-yl)-2-piperazin-1-ylacetamide.
What is the SMILES notation for 2-(2,3-dihydro-1-benzofuran-5-yl)-2-piperazin-1-ylacetamide?
The canonical SMILES for 2-(2,3-dihydro-1-benzofuran-5-yl)-2-piperazin-1-ylacetamide is NC(=O)C(c1ccc2c(c1)CCO2)N1CCNCC1.
What is the InChIKey of 2-(2,3-dihydro-1-benzofuran-5-yl)-2-piperazin-1-ylacetamide?
The InChIKey is PMENFDDDPNXCGI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3O2/c15-14(18)13(17-6-4-16-5-7-17)11-1-2-12-10(9-11)3-8-19-12/h1-2,9,13,16H,3-8H2,(H2,15,18).
What are the key properties of 2-(2,3-dihydro-1-benzofuran-5-yl)-2-piperazin-1-ylacetamide?
2-(2,3-dihydro-1-benzofuran-5-yl)-2-piperazin-1-ylacetamide has a molecular weight of 261.32 g/mol, XLogP of 0.05, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,3-dihydro-1-benzofuran-5-yl)-2-piperazin-1-ylacetamide is sourced from PubChem (CID 54892195), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).