(1,4-dimethylpiperazin-2-yl)-(2-propan-2-ylmorpholin-4-yl)methanone

C14H27N3O2 — CID 58469068

IUPAC(1,4-dimethylpiperazin-2-yl)-(2-propan-2-ylmorpholin-4-yl)methanone
SMILESCC(C)C1CN(C(=O)C2CN(C)CCN2C)CCO1
InChIInChI=1S/C14H27N3O2/c1-11(2)13-10-17(7-8-19-13)14(18)12-9-15(3)5-6-16(12)4/h11-13H,5-10H2,1-4H3
InChIKeyHBURLNYXRBAISG-UHFFFAOYSA-N
MW269.39 g/mol
LogP0.12
Rot. Bonds2

About (1,4-dimethylpiperazin-2-yl)-(2-propan-2-ylmorpholin-4-yl)methanone

(1,4-dimethylpiperazin-2-yl)-(2-propan-2-ylmorpholin-4-yl)methanone (PubChem CID 58469068) has the molecular formula C14H27N3O2 and a molecular weight of 269.39 g/mol. Its IUPAC name is (1,4-dimethylpiperazin-2-yl)-(2-propan-2-ylmorpholin-4-yl)methanone.

Molecular Properties

Compound Name(1,4-dimethylpiperazin-2-yl)-(2-propan-2-ylmorpholin-4-yl)methanone
PubChem CID58469068
Molecular FormulaC14H27N3O2
Molecular Weight269.39 g/mol
Exact Mass269.21
IUPAC Name(1,4-dimethylpiperazin-2-yl)-(2-propan-2-ylmorpholin-4-yl)methanone
SMILESCC(C)C1CN(C(=O)C2CN(C)CCN2C)CCO1
InChIInChI=1S/C14H27N3O2/c1-11(2)13-10-17(7-8-19-13)14(18)12-9-15(3)5-6-16(12)4/h11-13H,5-10H2,1-4H3
InChIKeyHBURLNYXRBAISG-UHFFFAOYSA-N
XLogP0.12
TPSA36.02 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.39
LogP ≤ 50.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (1,4-dimethylpiperazin-2-yl)-(2-propan-2-ylmorpholin-4-yl)methanone?
The IUPAC name of (1,4-dimethylpiperazin-2-yl)-(2-propan-2-ylmorpholin-4-yl)methanone (CID 58469068) is (1,4-dimethylpiperazin-2-yl)-(2-propan-2-ylmorpholin-4-yl)methanone.
What is the SMILES notation for (1,4-dimethylpiperazin-2-yl)-(2-propan-2-ylmorpholin-4-yl)methanone?
The canonical SMILES for (1,4-dimethylpiperazin-2-yl)-(2-propan-2-ylmorpholin-4-yl)methanone is CC(C)C1CN(C(=O)C2CN(C)CCN2C)CCO1.
What is the InChIKey of (1,4-dimethylpiperazin-2-yl)-(2-propan-2-ylmorpholin-4-yl)methanone?
The InChIKey is HBURLNYXRBAISG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27N3O2/c1-11(2)13-10-17(7-8-19-13)14(18)12-9-15(3)5-6-16(12)4/h11-13H,5-10H2,1-4H3.
What are the key properties of (1,4-dimethylpiperazin-2-yl)-(2-propan-2-ylmorpholin-4-yl)methanone?
(1,4-dimethylpiperazin-2-yl)-(2-propan-2-ylmorpholin-4-yl)methanone has a molecular weight of 269.39 g/mol, XLogP of 0.12, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (1,4-dimethylpiperazin-2-yl)-(2-propan-2-ylmorpholin-4-yl)methanone is sourced from PubChem (CID 58469068), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).