formaldehyde;methane;1-(4-methylpiperazin-1-yl)ethanone

C9H20N2O2 — CID 143691065

IUPACformaldehyde;methane;1-(4-methylpiperazin-1-yl)ethanone
SMILESC.C=O.CC(=O)N1CCN(C)CC1
InChIInChI=1S/C7H14N2O.CH2O.CH4/c1-7(10)9-5-3-8(2)4-6-9;1-2;/h3-6H2,1-2H3;1H2;1H4
InChIKeyIVONPHBXBNGRLX-UHFFFAOYSA-N
MW188.27 g/mol
LogP0.23
Rot. Bonds

About formaldehyde;methane;1-(4-methylpiperazin-1-yl)ethanone

formaldehyde;methane;1-(4-methylpiperazin-1-yl)ethanone (PubChem CID 143691065) has the molecular formula C9H20N2O2 and a molecular weight of 188.27 g/mol. Its IUPAC name is formaldehyde;methane;1-(4-methylpiperazin-1-yl)ethanone.

Molecular Properties

Compound Nameformaldehyde;methane;1-(4-methylpiperazin-1-yl)ethanone
PubChem CID143691065
Molecular FormulaC9H20N2O2
Molecular Weight188.27 g/mol
Exact Mass188.15
IUPAC Nameformaldehyde;methane;1-(4-methylpiperazin-1-yl)ethanone
SMILESC.C=O.CC(=O)N1CCN(C)CC1
InChIInChI=1S/C7H14N2O.CH2O.CH4/c1-7(10)9-5-3-8(2)4-6-9;1-2;/h3-6H2,1-2H3;1H2;1H4
InChIKeyIVONPHBXBNGRLX-UHFFFAOYSA-N
XLogP0.23
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.27
LogP ≤ 50.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1,1'-(1,4-Piperazinediyl)bis(ethanone)
CID 95851
1-Acetyl-4-methylpiperazine
CID 550758
1,4-Dipropionylpiperazine
CID 95171
1,1-Dimethyl-4-acetylpiperazinium
CID 4392675
Piperazine, 4-methyl-1-propionyl-
CID 114361
1,1-Dimethyl-4-acetylpiperazinium iodide
CID 5311072
1-(4-Acetylpiperazin-1-yl)propan-1-one
CID 22956481
1,4-Dipropylpiperazine-2,5-dione
CID 20186172
1-(4-Ethylpiperazin-1-yl)ethanone
CID 4305495
N,N'-(Ethane-1,2-diyl)bis(N-methylacetamide)
CID 12807949
2,3-Piperazinedione, 1,4-diethyl-
CID 20687048
1,4-Diethylpiperazin-2-one
CID 581342

Frequently Asked Questions

What is the IUPAC name of formaldehyde;methane;1-(4-methylpiperazin-1-yl)ethanone?
The IUPAC name of formaldehyde;methane;1-(4-methylpiperazin-1-yl)ethanone (CID 143691065) is formaldehyde;methane;1-(4-methylpiperazin-1-yl)ethanone.
What is the SMILES notation for formaldehyde;methane;1-(4-methylpiperazin-1-yl)ethanone?
The canonical SMILES for formaldehyde;methane;1-(4-methylpiperazin-1-yl)ethanone is C.C=O.CC(=O)N1CCN(C)CC1.
What is the InChIKey of formaldehyde;methane;1-(4-methylpiperazin-1-yl)ethanone?
The InChIKey is IVONPHBXBNGRLX-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14N2O.CH2O.CH4/c1-7(10)9-5-3-8(2)4-6-9;1-2;/h3-6H2,1-2H3;1H2;1H4.
What are the key properties of formaldehyde;methane;1-(4-methylpiperazin-1-yl)ethanone?
formaldehyde;methane;1-(4-methylpiperazin-1-yl)ethanone has a molecular weight of 188.27 g/mol, XLogP of 0.23, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for formaldehyde;methane;1-(4-methylpiperazin-1-yl)ethanone is sourced from PubChem (CID 143691065), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).