piperazin-1-yl-(4-propan-2-ylpiperazin-1-yl)methanone

C12H24N4O — CID 43585190

IUPACpiperazin-1-yl-(4-propan-2-ylpiperazin-1-yl)methanone
SMILESCC(C)N1CCN(C(=O)N2CCNCC2)CC1
InChIInChI=1S/C12H24N4O/c1-11(2)14-7-9-16(10-8-14)12(17)15-5-3-13-4-6-15/h11,13H,3-10H2,1-2H3
InChIKeyMKKIFYKIFDTXQI-UHFFFAOYSA-N
MW240.35 g/mol
LogP0.04
Rot. Bonds1

About piperazin-1-yl-(4-propan-2-ylpiperazin-1-yl)methanone

piperazin-1-yl-(4-propan-2-ylpiperazin-1-yl)methanone (PubChem CID 43585190) has the molecular formula C12H24N4O and a molecular weight of 240.35 g/mol. Its IUPAC name is piperazin-1-yl-(4-propan-2-ylpiperazin-1-yl)methanone.

Molecular Properties

Compound Namepiperazin-1-yl-(4-propan-2-ylpiperazin-1-yl)methanone
PubChem CID43585190
Molecular FormulaC12H24N4O
Molecular Weight240.35 g/mol
Exact Mass240.20
IUPAC Namepiperazin-1-yl-(4-propan-2-ylpiperazin-1-yl)methanone
SMILESCC(C)N1CCN(C(=O)N2CCNCC2)CC1
InChIInChI=1S/C12H24N4O/c1-11(2)14-7-9-16(10-8-14)12(17)15-5-3-13-4-6-15/h11,13H,3-10H2,1-2H3
InChIKeyMKKIFYKIFDTXQI-UHFFFAOYSA-N
XLogP0.04
TPSA38.82 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.35
LogP ≤ 50.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

n,n'-Diethylpiperazine-1,4-dicarboxamide
CID 235434
N-(1,1-Dimethylethyl)-1-piperazinecarboxamide
CID 11321368
n-Ethyl-4-methylpiperazine-1-carboxamide
CID 116045
N,N-Diethylpiperazine-1-carboxamide
CID 67067
N,N'-dipropyl-1,4-piperazinedicarboxamide
CID 2174167
1-[2-(Piperazin-1-yl)ethyl]-3-(propan-2-yl)urea
CID 43600356
N-(propan-2-yl)piperazine-1-carboxamide hydrochloride
CID 17811303
4-(1-methylpiperidin-4-yl)-N-(2-methylpropyl)piperazine-1-carboxamide
CID 172435138
4-methyl-N-propylpiperazine-1-carboxamide
CID 6461326
N-Isopropylpiperazine-1-carboxamide
CID 16740267
3-methyl-N-(propan-2-yl)piperazine-1-carboxamide
CID 53933480
1-Piperazinecarboxamide, N-[2-(diethylamino)ethyl]-4-methyl-
CID 515599

Frequently Asked Questions

What is the IUPAC name of piperazin-1-yl-(4-propan-2-ylpiperazin-1-yl)methanone?
The IUPAC name of piperazin-1-yl-(4-propan-2-ylpiperazin-1-yl)methanone (CID 43585190) is piperazin-1-yl-(4-propan-2-ylpiperazin-1-yl)methanone.
What is the SMILES notation for piperazin-1-yl-(4-propan-2-ylpiperazin-1-yl)methanone?
The canonical SMILES for piperazin-1-yl-(4-propan-2-ylpiperazin-1-yl)methanone is CC(C)N1CCN(C(=O)N2CCNCC2)CC1.
What is the InChIKey of piperazin-1-yl-(4-propan-2-ylpiperazin-1-yl)methanone?
The InChIKey is MKKIFYKIFDTXQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N4O/c1-11(2)14-7-9-16(10-8-14)12(17)15-5-3-13-4-6-15/h11,13H,3-10H2,1-2H3.
What are the key properties of piperazin-1-yl-(4-propan-2-ylpiperazin-1-yl)methanone?
piperazin-1-yl-(4-propan-2-ylpiperazin-1-yl)methanone has a molecular weight of 240.35 g/mol, XLogP of 0.04, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for piperazin-1-yl-(4-propan-2-ylpiperazin-1-yl)methanone is sourced from PubChem (CID 43585190), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).