N-[1-(furan-2-yl)ethyl]-2-piperazin-1-ylacetamide

C12H19N3O2 — CID 43162415

IUPACN-[1-(furan-2-yl)ethyl]-2-piperazin-1-ylacetamide
SMILESCC(NC(=O)CN1CCNCC1)c1ccco1
InChIInChI=1S/C12H19N3O2/c1-10(11-3-2-8-17-11)14-12(16)9-15-6-4-13-5-7-15/h2-3,8,10,13H,4-7,9H2,1H3,(H,14,16)
InChIKeyWYQMQTIRPYIVTM-UHFFFAOYSA-N
MW237.30 g/mol
LogP0.36
Rot. Bonds4

About N-[1-(furan-2-yl)ethyl]-2-piperazin-1-ylacetamide

N-[1-(furan-2-yl)ethyl]-2-piperazin-1-ylacetamide (PubChem CID 43162415) has the molecular formula C12H19N3O2 and a molecular weight of 237.30 g/mol. Its IUPAC name is N-[1-(furan-2-yl)ethyl]-2-piperazin-1-ylacetamide.

Molecular Properties

Compound NameN-[1-(furan-2-yl)ethyl]-2-piperazin-1-ylacetamide
PubChem CID43162415
Molecular FormulaC12H19N3O2
Molecular Weight237.30 g/mol
Exact Mass237.15
IUPAC NameN-[1-(furan-2-yl)ethyl]-2-piperazin-1-ylacetamide
SMILESCC(NC(=O)CN1CCNCC1)c1ccco1
InChIInChI=1S/C12H19N3O2/c1-10(11-3-2-8-17-11)14-12(16)9-15-6-4-13-5-7-15/h2-3,8,10,13H,4-7,9H2,1H3,(H,14,16)
InChIKeyWYQMQTIRPYIVTM-UHFFFAOYSA-N
XLogP0.36
TPSA57.51 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.30
LogP ≤ 50.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-(4-aminopiperidin-1-yl)-N-[1-(furan-2-yl)ethyl]acetamide
CID 43556867
N-[4-(furan-2-yl)butan-2-yl]-2-piperazin-1-ylacetamide
CID 61249923
N-(1-phenylethyl)-2-piperazin-1-ylacetamide
CID 23080516
2-[4,7-bis[2-oxo-2-[[(1R)-1-phenylethyl]amino]ethyl]-1,4,7,10-tetrazacyclododec-1-yl]-N-[(1R)-1-phenylethyl]acetamide
CID 11285246
N-[(1S)-1-(furan-2-yl)ethyl]-2-[4-[(2-methylphenyl)methyl]piperazin-1-yl]acetamide
CID 8596472
2-(4-benzylpiperidin-1-yl)-N-[(1S)-1-(furan-2-yl)ethyl]acetamide
CID 9430556
N-[(1S)-1-(furan-2-yl)ethyl]-2-[4-[(3-methylphenyl)methyl]piperazin-1-yl]acetamide
CID 8597892
N-[1-(furan-2-yl)ethyl]-2-[3-(methylaminomethyl)pyrrolidin-1-yl]acetamide
CID 55168863
2-(1,3-dioxoisoindol-2-yl)-N-[(1R)-1-(furan-2-yl)ethyl]acetamide
CID 9017578
N-[(1R)-1-(3-bromophenyl)ethyl]-2-piperazin-1-ylacetamide
CID 81376325
2-piperazin-1-yl-N-[(1R)-1-pyridin-2-ylethyl]acetamide
CID 81407274
N-[(1S)-1-(furan-2-yl)ethyl]-2-[4-[(1S)-1-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]piperazin-1-yl]acetamide
CID 95278550

Frequently Asked Questions

What is the IUPAC name of N-[1-(furan-2-yl)ethyl]-2-piperazin-1-ylacetamide?
The IUPAC name of N-[1-(furan-2-yl)ethyl]-2-piperazin-1-ylacetamide (CID 43162415) is N-[1-(furan-2-yl)ethyl]-2-piperazin-1-ylacetamide.
What is the SMILES notation for N-[1-(furan-2-yl)ethyl]-2-piperazin-1-ylacetamide?
The canonical SMILES for N-[1-(furan-2-yl)ethyl]-2-piperazin-1-ylacetamide is CC(NC(=O)CN1CCNCC1)c1ccco1.
What is the InChIKey of N-[1-(furan-2-yl)ethyl]-2-piperazin-1-ylacetamide?
The InChIKey is WYQMQTIRPYIVTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3O2/c1-10(11-3-2-8-17-11)14-12(16)9-15-6-4-13-5-7-15/h2-3,8,10,13H,4-7,9H2,1H3,(H,14,16).
What are the key properties of N-[1-(furan-2-yl)ethyl]-2-piperazin-1-ylacetamide?
N-[1-(furan-2-yl)ethyl]-2-piperazin-1-ylacetamide has a molecular weight of 237.30 g/mol, XLogP of 0.36, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(furan-2-yl)ethyl]-2-piperazin-1-ylacetamide is sourced from PubChem (CID 43162415), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).