2-methylfuran;1-piperazin-1-ylethanone

C11H18N2O2 — CID 143298157

IUPAC2-methylfuran;1-piperazin-1-ylethanone
SMILESCC(=O)N1CCNCC1.Cc1ccco1
InChIInChI=1S/C6H12N2O.C5H6O/c1-6(9)8-4-2-7-3-5-8;1-5-3-2-4-6-5/h7H,2-5H2,1H3;2-4H,1H3
InChIKeyRHLNYWJVNCFVBR-UHFFFAOYSA-N
MW210.28 g/mol
LogP1.03
Rot. Bonds

About 2-methylfuran;1-piperazin-1-ylethanone

2-methylfuran;1-piperazin-1-ylethanone (PubChem CID 143298157) has the molecular formula C11H18N2O2 and a molecular weight of 210.28 g/mol. Its IUPAC name is 2-methylfuran;1-piperazin-1-ylethanone.

Molecular Properties

Compound Name2-methylfuran;1-piperazin-1-ylethanone
PubChem CID143298157
Molecular FormulaC11H18N2O2
Molecular Weight210.28 g/mol
Exact Mass210.14
IUPAC Name2-methylfuran;1-piperazin-1-ylethanone
SMILESCC(=O)N1CCNCC1.Cc1ccco1
InChIInChI=1S/C6H12N2O.C5H6O/c1-6(9)8-4-2-7-3-5-8;1-5-3-2-4-6-5/h7H,2-5H2,1H3;2-4H,1H3
InChIKeyRHLNYWJVNCFVBR-UHFFFAOYSA-N
XLogP1.03
TPSA45.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.28
LogP ≤ 51.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(E)-3-(furan-2-yl)-2-methyl-1-piperazin-1-ylprop-2-en-1-one
CID 70591548
ethene;1-piperazin-1-ylethanone
CID 145071339
1-[1-(furan-2-yl)ethenyl]piperazine
CID 89343941
1-(4-acetylpiperazin-1-yl)-2-piperazin-1-ylethane-1,2-dione
CID 28507184
[2-(furan-2-yl)-4-methyl-1,3-thiazol-5-yl]-piperazin-1-ylmethanone
CID 94285993
1-(4-methoxyphenyl)piperazine;1-piperazin-1-ylethanone
CID 173297247
ethene;2-methylfuran
CID 67469652
3-fluoroaniline;1-piperazin-1-ylethanone
CID 69484090
furan-2-yl-(3-methylpiperazin-1-yl)methanone
CID 64980953
2-(furan-2-yl)-2-piperazin-1-ylacetic acid
CID 82077936
2-methylfuran;propane
CID 142817027
furan-2-ylmethyl 1,4-diazepane-1-carboxylate
CID 82287342

Frequently Asked Questions

What is the IUPAC name of 2-methylfuran;1-piperazin-1-ylethanone?
The IUPAC name of 2-methylfuran;1-piperazin-1-ylethanone (CID 143298157) is 2-methylfuran;1-piperazin-1-ylethanone.
What is the SMILES notation for 2-methylfuran;1-piperazin-1-ylethanone?
The canonical SMILES for 2-methylfuran;1-piperazin-1-ylethanone is CC(=O)N1CCNCC1.Cc1ccco1.
What is the InChIKey of 2-methylfuran;1-piperazin-1-ylethanone?
The InChIKey is RHLNYWJVNCFVBR-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H12N2O.C5H6O/c1-6(9)8-4-2-7-3-5-8;1-5-3-2-4-6-5/h7H,2-5H2,1H3;2-4H,1H3.
What are the key properties of 2-methylfuran;1-piperazin-1-ylethanone?
2-methylfuran;1-piperazin-1-ylethanone has a molecular weight of 210.28 g/mol, XLogP of 1.03, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methylfuran;1-piperazin-1-ylethanone is sourced from PubChem (CID 143298157), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).