2-(4-cyclopentylpiperazin-1-yl)-2-(1,5-dimethylimidazol-4-yl)ethanamine

C16H29N5 — CID 84743785

IUPAC2-(4-cyclopentylpiperazin-1-yl)-2-(1,5-dimethylimidazol-4-yl)ethanamine
SMILESCc1c(C(CN)N2CCN(C3CCCC3)CC2)ncn1C
InChIInChI=1S/C16H29N5/c1-13-16(18-12-19(13)2)15(11-17)21-9-7-20(8-10-21)14-5-3-4-6-14/h12,14-15H,3-11,17H2,1-2H3
InChIKeyZLKBDPKSXLUQPT-UHFFFAOYSA-N
MW291.44 g/mol
LogP1.29
Rot. Bonds4

About 2-(4-cyclopentylpiperazin-1-yl)-2-(1,5-dimethylimidazol-4-yl)ethanamine

2-(4-cyclopentylpiperazin-1-yl)-2-(1,5-dimethylimidazol-4-yl)ethanamine (PubChem CID 84743785) has the molecular formula C16H29N5 and a molecular weight of 291.44 g/mol. Its IUPAC name is 2-(4-cyclopentylpiperazin-1-yl)-2-(1,5-dimethylimidazol-4-yl)ethanamine.

Molecular Properties

Compound Name2-(4-cyclopentylpiperazin-1-yl)-2-(1,5-dimethylimidazol-4-yl)ethanamine
PubChem CID84743785
Molecular FormulaC16H29N5
Molecular Weight291.44 g/mol
Exact Mass291.24
IUPAC Name2-(4-cyclopentylpiperazin-1-yl)-2-(1,5-dimethylimidazol-4-yl)ethanamine
SMILESCc1c(C(CN)N2CCN(C3CCCC3)CC2)ncn1C
InChIInChI=1S/C16H29N5/c1-13-16(18-12-19(13)2)15(11-17)21-9-7-20(8-10-21)14-5-3-4-6-14/h12,14-15H,3-11,17H2,1-2H3
InChIKeyZLKBDPKSXLUQPT-UHFFFAOYSA-N
XLogP1.29
TPSA50.32 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.44
LogP ≤ 51.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(4-cyclopentylpiperazin-1-yl)-2-(1,5-dimethylimidazol-4-yl)ethanamine?
The IUPAC name of 2-(4-cyclopentylpiperazin-1-yl)-2-(1,5-dimethylimidazol-4-yl)ethanamine (CID 84743785) is 2-(4-cyclopentylpiperazin-1-yl)-2-(1,5-dimethylimidazol-4-yl)ethanamine.
What is the SMILES notation for 2-(4-cyclopentylpiperazin-1-yl)-2-(1,5-dimethylimidazol-4-yl)ethanamine?
The canonical SMILES for 2-(4-cyclopentylpiperazin-1-yl)-2-(1,5-dimethylimidazol-4-yl)ethanamine is Cc1c(C(CN)N2CCN(C3CCCC3)CC2)ncn1C.
What is the InChIKey of 2-(4-cyclopentylpiperazin-1-yl)-2-(1,5-dimethylimidazol-4-yl)ethanamine?
The InChIKey is ZLKBDPKSXLUQPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H29N5/c1-13-16(18-12-19(13)2)15(11-17)21-9-7-20(8-10-21)14-5-3-4-6-14/h12,14-15H,3-11,17H2,1-2H3.
What are the key properties of 2-(4-cyclopentylpiperazin-1-yl)-2-(1,5-dimethylimidazol-4-yl)ethanamine?
2-(4-cyclopentylpiperazin-1-yl)-2-(1,5-dimethylimidazol-4-yl)ethanamine has a molecular weight of 291.44 g/mol, XLogP of 1.29, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-cyclopentylpiperazin-1-yl)-2-(1,5-dimethylimidazol-4-yl)ethanamine is sourced from PubChem (CID 84743785), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).