(4-cyclopentylpiperazin-1-yl)-(2-methylmorpholin-2-yl)methanone

C15H27N3O2 — CID 118740161

IUPAC(4-cyclopentylpiperazin-1-yl)-(2-methylmorpholin-2-yl)methanone
SMILESCC1(C(=O)N2CCN(C3CCCC3)CC2)CNCCO1
InChIInChI=1S/C15H27N3O2/c1-15(12-16-6-11-20-15)14(19)18-9-7-17(8-10-18)13-4-2-3-5-13/h13,16H,2-12H2,1H3
InChIKeyINWZASCBKPCIKL-UHFFFAOYSA-N
MW281.40 g/mol
LogP0.45
Rot. Bonds2

About (4-cyclopentylpiperazin-1-yl)-(2-methylmorpholin-2-yl)methanone

(4-cyclopentylpiperazin-1-yl)-(2-methylmorpholin-2-yl)methanone (PubChem CID 118740161) has the molecular formula C15H27N3O2 and a molecular weight of 281.40 g/mol. Its IUPAC name is (4-cyclopentylpiperazin-1-yl)-(2-methylmorpholin-2-yl)methanone.

Molecular Properties

Compound Name(4-cyclopentylpiperazin-1-yl)-(2-methylmorpholin-2-yl)methanone
PubChem CID118740161
Molecular FormulaC15H27N3O2
Molecular Weight281.40 g/mol
Exact Mass281.21
IUPAC Name(4-cyclopentylpiperazin-1-yl)-(2-methylmorpholin-2-yl)methanone
SMILESCC1(C(=O)N2CCN(C3CCCC3)CC2)CNCCO1
InChIInChI=1S/C15H27N3O2/c1-15(12-16-6-11-20-15)14(19)18-9-7-17(8-10-18)13-4-2-3-5-13/h13,16H,2-12H2,1H3
InChIKeyINWZASCBKPCIKL-UHFFFAOYSA-N
XLogP0.45
TPSA44.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.40
LogP ≤ 50.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (4-cyclopentylpiperazin-1-yl)-(2-methylmorpholin-2-yl)methanone?
The IUPAC name of (4-cyclopentylpiperazin-1-yl)-(2-methylmorpholin-2-yl)methanone (CID 118740161) is (4-cyclopentylpiperazin-1-yl)-(2-methylmorpholin-2-yl)methanone.
What is the SMILES notation for (4-cyclopentylpiperazin-1-yl)-(2-methylmorpholin-2-yl)methanone?
The canonical SMILES for (4-cyclopentylpiperazin-1-yl)-(2-methylmorpholin-2-yl)methanone is CC1(C(=O)N2CCN(C3CCCC3)CC2)CNCCO1.
What is the InChIKey of (4-cyclopentylpiperazin-1-yl)-(2-methylmorpholin-2-yl)methanone?
The InChIKey is INWZASCBKPCIKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27N3O2/c1-15(12-16-6-11-20-15)14(19)18-9-7-17(8-10-18)13-4-2-3-5-13/h13,16H,2-12H2,1H3.
What are the key properties of (4-cyclopentylpiperazin-1-yl)-(2-methylmorpholin-2-yl)methanone?
(4-cyclopentylpiperazin-1-yl)-(2-methylmorpholin-2-yl)methanone has a molecular weight of 281.40 g/mol, XLogP of 0.45, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (4-cyclopentylpiperazin-1-yl)-(2-methylmorpholin-2-yl)methanone is sourced from PubChem (CID 118740161), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).