3-butan-2-yl-1-(2-methylcyclopentyl)piperazine

C14H28N2 — CID 64952202

IUPAC3-butan-2-yl-1-(2-methylcyclopentyl)piperazine
SMILESCCC(C)C1CN(C2CCCC2C)CCN1
InChIInChI=1S/C14H28N2/c1-4-11(2)13-10-16(9-8-15-13)14-7-5-6-12(14)3/h11-15H,4-10H2,1-3H3
InChIKeyYNCQRHGUPHJOJO-UHFFFAOYSA-N
MW224.39 g/mol
LogP2.49
Rot. Bonds3

About 3-butan-2-yl-1-(2-methylcyclopentyl)piperazine

3-butan-2-yl-1-(2-methylcyclopentyl)piperazine (PubChem CID 64952202) has the molecular formula C14H28N2 and a molecular weight of 224.39 g/mol. Its IUPAC name is 3-butan-2-yl-1-(2-methylcyclopentyl)piperazine.

Molecular Properties

Compound Name3-butan-2-yl-1-(2-methylcyclopentyl)piperazine
PubChem CID64952202
Molecular FormulaC14H28N2
Molecular Weight224.39 g/mol
Exact Mass224.23
IUPAC Name3-butan-2-yl-1-(2-methylcyclopentyl)piperazine
SMILESCCC(C)C1CN(C2CCCC2C)CCN1
InChIInChI=1S/C14H28N2/c1-4-11(2)13-10-16(9-8-15-13)14-7-5-6-12(14)3/h11-15H,4-10H2,1-3H3
InChIKeyYNCQRHGUPHJOJO-UHFFFAOYSA-N
XLogP2.49
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.39
LogP ≤ 52.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-butan-2-yl-1-(2-ethylcyclohexyl)piperazine
CID 64923764
3-butan-2-yl-1-(2-methylsulfanylcyclohexyl)piperazine
CID 114122790
3-butan-2-yl-1-(2-methyloxan-4-yl)piperazine
CID 114109431
3-butan-2-yl-1-(3-methylcyclohexyl)-1,4-diazepane
CID 64943533
3-butan-2-yl-1-(1-propylpiperidin-4-yl)piperazine
CID 64924764
3-(3-butan-2-ylpiperazin-1-yl)-N,N-dimethyl-3H-1,2,4-dithiazol-5-amine
CID 54225744
3-butan-2-yl-1-(2-phenylcyclopropyl)-1,4-diazepane
CID 64950135
5-butan-2-yl-1-(2,3-dimethylcyclohexyl)-2-propan-2-ylpiperazine
CID 64953097
1-(2,3-dimethylcyclohexyl)-3-(2-methylpropyl)piperazine
CID 64924428
3-butan-2-yl-1-(3-methoxycyclohexyl)-1,4-diazepane
CID 64858248
3-butan-2-yl-1-(oxolan-3-yl)-1,4-diazepane
CID 64858241
3-butan-2-yl-1-[(4-methylcyclohexyl)methyl]piperazine
CID 64954197

Frequently Asked Questions

What is the IUPAC name of 3-butan-2-yl-1-(2-methylcyclopentyl)piperazine?
The IUPAC name of 3-butan-2-yl-1-(2-methylcyclopentyl)piperazine (CID 64952202) is 3-butan-2-yl-1-(2-methylcyclopentyl)piperazine.
What is the SMILES notation for 3-butan-2-yl-1-(2-methylcyclopentyl)piperazine?
The canonical SMILES for 3-butan-2-yl-1-(2-methylcyclopentyl)piperazine is CCC(C)C1CN(C2CCCC2C)CCN1.
What is the InChIKey of 3-butan-2-yl-1-(2-methylcyclopentyl)piperazine?
The InChIKey is YNCQRHGUPHJOJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2/c1-4-11(2)13-10-16(9-8-15-13)14-7-5-6-12(14)3/h11-15H,4-10H2,1-3H3.
What are the key properties of 3-butan-2-yl-1-(2-methylcyclopentyl)piperazine?
3-butan-2-yl-1-(2-methylcyclopentyl)piperazine has a molecular weight of 224.39 g/mol, XLogP of 2.49, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-butan-2-yl-1-(2-methylcyclopentyl)piperazine is sourced from PubChem (CID 64952202), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).