4-(4-cyclopentylpiperazin-1-yl)-2-methylpyrimidine

C14H22N4 — CID 121184719

IUPAC4-(4-cyclopentylpiperazin-1-yl)-2-methylpyrimidine
SMILESCc1nccc(N2CCN(C3CCCC3)CC2)n1
InChIInChI=1S/C14H22N4/c1-12-15-7-6-14(16-12)18-10-8-17(9-11-18)13-4-2-3-5-13/h6-7,13H,2-5,8-11H2,1H3
InChIKeyWYTRMFNHDFTKHH-UHFFFAOYSA-N
MW246.36 g/mol
LogP1.85
Rot. Bonds2

About 4-(4-cyclopentylpiperazin-1-yl)-2-methylpyrimidine

4-(4-cyclopentylpiperazin-1-yl)-2-methylpyrimidine (PubChem CID 121184719) has the molecular formula C14H22N4 and a molecular weight of 246.36 g/mol. Its IUPAC name is 4-(4-cyclopentylpiperazin-1-yl)-2-methylpyrimidine.

Molecular Properties

Compound Name4-(4-cyclopentylpiperazin-1-yl)-2-methylpyrimidine
PubChem CID121184719
Molecular FormulaC14H22N4
Molecular Weight246.36 g/mol
Exact Mass246.18
IUPAC Name4-(4-cyclopentylpiperazin-1-yl)-2-methylpyrimidine
SMILESCc1nccc(N2CCN(C3CCCC3)CC2)n1
InChIInChI=1S/C14H22N4/c1-12-15-7-6-14(16-12)18-10-8-17(9-11-18)13-4-2-3-5-13/h6-7,13H,2-5,8-11H2,1H3
InChIKeyWYTRMFNHDFTKHH-UHFFFAOYSA-N
XLogP1.85
TPSA32.26 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.36
LogP ≤ 51.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 4-(4-cyclopentylpiperazin-1-yl)-2-methylpyrimidine 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

1-cyclopentyl-4-(2-methylpyrimidin-4-yl)-1,4-diazepane
CID 154742612
2-methyl-4-[4-(oxan-4-yl)piperazin-1-yl]pyrimidine
CID 123694030
1-(2-methylpyrimidin-4-yl)azepane
CID 126972484
2-methyl-4-[3-(4-pyrimidin-2-ylpiperazin-1-yl)azetidin-1-yl]pyrimidine
CID 126893871
methanamine;2-methyl-4-pyrrolidin-1-ylpyrimidine
CID 143912521
4-(4-tert-butylpiperidin-1-yl)-2-methylpyrimidine
CID 58359326
4-[[3-(4-cyclohexylpiperazin-1-yl)azetidin-1-yl]methyl]-2-methylpyrimidine
CID 126892666
2-methyl-4-(4-phenylpiperidin-1-yl)pyrimidine
CID 136528453
2-(4-cyclopentylpiperazin-1-yl)pyridin-4-amine
CID 62367922
[4-(4-cyclopropylpiperazin-1-yl)pyrimidin-2-yl]hydrazine
CID 80895559
2-(4-cyclopentylpiperazin-1-yl)pyridine-4-carboxylic acid
CID 62369629
ethane;2-methyl-4-piperazin-1-ylpyrimidine
CID 144746590

Frequently Asked Questions

What is the IUPAC name of 4-(4-cyclopentylpiperazin-1-yl)-2-methylpyrimidine?
The IUPAC name of 4-(4-cyclopentylpiperazin-1-yl)-2-methylpyrimidine (CID 121184719) is 4-(4-cyclopentylpiperazin-1-yl)-2-methylpyrimidine.
What is the SMILES notation for 4-(4-cyclopentylpiperazin-1-yl)-2-methylpyrimidine?
The canonical SMILES for 4-(4-cyclopentylpiperazin-1-yl)-2-methylpyrimidine is Cc1nccc(N2CCN(C3CCCC3)CC2)n1.
What is the InChIKey of 4-(4-cyclopentylpiperazin-1-yl)-2-methylpyrimidine?
The InChIKey is WYTRMFNHDFTKHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N4/c1-12-15-7-6-14(16-12)18-10-8-17(9-11-18)13-4-2-3-5-13/h6-7,13H,2-5,8-11H2,1H3.
What are the key properties of 4-(4-cyclopentylpiperazin-1-yl)-2-methylpyrimidine?
4-(4-cyclopentylpiperazin-1-yl)-2-methylpyrimidine has a molecular weight of 246.36 g/mol, XLogP of 1.85, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-cyclopentylpiperazin-1-yl)-2-methylpyrimidine is sourced from PubChem (CID 121184719), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).