2-methyl-2-[[4-(2-methylpropyl)piperazin-1-yl]methyl]cyclopentan-1-amine

C15H31N3 — CID 82768206

IUPAC2-methyl-2-[[4-(2-methylpropyl)piperazin-1-yl]methyl]cyclopentan-1-amine
SMILESCC(C)CN1CCN(CC2(C)CCCC2N)CC1
InChIInChI=1S/C15H31N3/c1-13(2)11-17-7-9-18(10-8-17)12-15(3)6-4-5-14(15)16/h13-14H,4-12,16H2,1-3H3
InChIKeyGNZADLALYZDTCY-UHFFFAOYSA-N
MW253.43 g/mol
LogP1.78
Rot. Bonds4

About 2-methyl-2-[[4-(2-methylpropyl)piperazin-1-yl]methyl]cyclopentan-1-amine

2-methyl-2-[[4-(2-methylpropyl)piperazin-1-yl]methyl]cyclopentan-1-amine (PubChem CID 82768206) has the molecular formula C15H31N3 and a molecular weight of 253.43 g/mol. Its IUPAC name is 2-methyl-2-[[4-(2-methylpropyl)piperazin-1-yl]methyl]cyclopentan-1-amine.

Molecular Properties

Compound Name2-methyl-2-[[4-(2-methylpropyl)piperazin-1-yl]methyl]cyclopentan-1-amine
PubChem CID82768206
Molecular FormulaC15H31N3
Molecular Weight253.43 g/mol
Exact Mass253.25
IUPAC Name2-methyl-2-[[4-(2-methylpropyl)piperazin-1-yl]methyl]cyclopentan-1-amine
SMILESCC(C)CN1CCN(CC2(C)CCCC2N)CC1
InChIInChI=1S/C15H31N3/c1-13(2)11-17-7-9-18(10-8-17)12-15(3)6-4-5-14(15)16/h13-14H,4-12,16H2,1-3H3
InChIKeyGNZADLALYZDTCY-UHFFFAOYSA-N
XLogP1.78
TPSA32.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.43
LogP ≤ 51.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-2-[[4-(2-methylpropyl)piperazin-1-yl]methyl]cyclopentan-1-amine?
The IUPAC name of 2-methyl-2-[[4-(2-methylpropyl)piperazin-1-yl]methyl]cyclopentan-1-amine (CID 82768206) is 2-methyl-2-[[4-(2-methylpropyl)piperazin-1-yl]methyl]cyclopentan-1-amine.
What is the SMILES notation for 2-methyl-2-[[4-(2-methylpropyl)piperazin-1-yl]methyl]cyclopentan-1-amine?
The canonical SMILES for 2-methyl-2-[[4-(2-methylpropyl)piperazin-1-yl]methyl]cyclopentan-1-amine is CC(C)CN1CCN(CC2(C)CCCC2N)CC1.
What is the InChIKey of 2-methyl-2-[[4-(2-methylpropyl)piperazin-1-yl]methyl]cyclopentan-1-amine?
The InChIKey is GNZADLALYZDTCY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H31N3/c1-13(2)11-17-7-9-18(10-8-17)12-15(3)6-4-5-14(15)16/h13-14H,4-12,16H2,1-3H3.
What are the key properties of 2-methyl-2-[[4-(2-methylpropyl)piperazin-1-yl]methyl]cyclopentan-1-amine?
2-methyl-2-[[4-(2-methylpropyl)piperazin-1-yl]methyl]cyclopentan-1-amine has a molecular weight of 253.43 g/mol, XLogP of 1.78, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-2-[[4-(2-methylpropyl)piperazin-1-yl]methyl]cyclopentan-1-amine is sourced from PubChem (CID 82768206), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).