1-(4-cyclopentylpiperazin-1-yl)-2-(4-methylpiperazin-1-yl)ethanone

C16H30N4O — CID 57442390

IUPAC1-(4-cyclopentylpiperazin-1-yl)-2-(4-methylpiperazin-1-yl)ethanone
SMILESCN1CCN(CC(=O)N2CCN(C3CCCC3)CC2)CC1
InChIInChI=1S/C16H30N4O/c1-17-6-8-18(9-7-17)14-16(21)20-12-10-19(11-13-20)15-4-2-3-5-15/h15H,2-14H2,1H3
InChIKeyQQRJFJWEPUTRMQ-UHFFFAOYSA-N
MW294.44 g/mol
LogP0.32
Rot. Bonds3

About 1-(4-cyclopentylpiperazin-1-yl)-2-(4-methylpiperazin-1-yl)ethanone

1-(4-cyclopentylpiperazin-1-yl)-2-(4-methylpiperazin-1-yl)ethanone (PubChem CID 57442390) has the molecular formula C16H30N4O and a molecular weight of 294.44 g/mol. Its IUPAC name is 1-(4-cyclopentylpiperazin-1-yl)-2-(4-methylpiperazin-1-yl)ethanone.

Molecular Properties

Compound Name1-(4-cyclopentylpiperazin-1-yl)-2-(4-methylpiperazin-1-yl)ethanone
PubChem CID57442390
Molecular FormulaC16H30N4O
Molecular Weight294.44 g/mol
Exact Mass294.24
IUPAC Name1-(4-cyclopentylpiperazin-1-yl)-2-(4-methylpiperazin-1-yl)ethanone
SMILESCN1CCN(CC(=O)N2CCN(C3CCCC3)CC2)CC1
InChIInChI=1S/C16H30N4O/c1-17-6-8-18(9-7-17)14-16(21)20-12-10-19(11-13-20)15-4-2-3-5-15/h15H,2-14H2,1H3
InChIKeyQQRJFJWEPUTRMQ-UHFFFAOYSA-N
XLogP0.32
TPSA30.03 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.44
LogP ≤ 50.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 1-(4-cyclopentylpiperazin-1-yl)-2-(4-methylpiperazin-1-yl)ethanone with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-cyclopentyl-2-(4-ethyl-3-methylpiperazin-1-yl)-N-methylacetamide
CID 49853577
1-(Piperidinoacetyl)piperidine
CID 12424322
1-(1-Acetyl-4-piperidinyl)-4-ethylpiperazine
CID 781966
N,N-dimethyl-2-(4-piperidin-1-ylpiperidin-1-yl)acetamide
CID 1439627
2-(2-Methylpiperidin-1-yl)-1-[4-[2-(2-methylpiperidin-1-yl)acetyl]piperazin-1-yl]ethanone
CID 3226817
2-(4-Methylpiperazin-1-yl)-1-(2-methylpiperidin-1-yl)ethanone
CID 3229438
1-(4-methylpiperazin-1-yl)-2-[(3S)-3-(4-methylpiperazin-1-yl)azepan-1-yl]ethanone
CID 97803391
2-(4-Fluoropiperidin-1-yl)-1-(2-methylpiperidin-1-yl)ethanone
CID 117710726
Piperazine impurity 50
CID 57781957
2-(1-Methylpiperidin-1-ium-1-yl)-1-[4-[2-(1-methylpiperidin-1-ium-1-yl)propanoyl]piperazin-1-yl]propan-1-one
CID 121529
1-[1-(2-Fluoro-2-methylpropanoyl)piperidin-3-yl]-4-(2-pyrrolidin-1-ylacetyl)piperazin-2-one
CID 138046482
2-(4-Piperidin-1-ylpiperidin-1-yl)-1-pyrrolidin-1-ylpropan-1-one
CID 3229562

Frequently Asked Questions

What is the IUPAC name of 1-(4-cyclopentylpiperazin-1-yl)-2-(4-methylpiperazin-1-yl)ethanone?
The IUPAC name of 1-(4-cyclopentylpiperazin-1-yl)-2-(4-methylpiperazin-1-yl)ethanone (CID 57442390) is 1-(4-cyclopentylpiperazin-1-yl)-2-(4-methylpiperazin-1-yl)ethanone.
What is the SMILES notation for 1-(4-cyclopentylpiperazin-1-yl)-2-(4-methylpiperazin-1-yl)ethanone?
The canonical SMILES for 1-(4-cyclopentylpiperazin-1-yl)-2-(4-methylpiperazin-1-yl)ethanone is CN1CCN(CC(=O)N2CCN(C3CCCC3)CC2)CC1.
What is the InChIKey of 1-(4-cyclopentylpiperazin-1-yl)-2-(4-methylpiperazin-1-yl)ethanone?
The InChIKey is QQRJFJWEPUTRMQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H30N4O/c1-17-6-8-18(9-7-17)14-16(21)20-12-10-19(11-13-20)15-4-2-3-5-15/h15H,2-14H2,1H3.
What are the key properties of 1-(4-cyclopentylpiperazin-1-yl)-2-(4-methylpiperazin-1-yl)ethanone?
1-(4-cyclopentylpiperazin-1-yl)-2-(4-methylpiperazin-1-yl)ethanone has a molecular weight of 294.44 g/mol, XLogP of 0.32, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-cyclopentylpiperazin-1-yl)-2-(4-methylpiperazin-1-yl)ethanone is sourced from PubChem (CID 57442390), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).