(4-methylpiperidin-4-yl)-piperidin-1-ylmethanone

C12H22N2O — CID 24728858

IUPAC(4-methylpiperidin-4-yl)-piperidin-1-ylmethanone
SMILESCC1(C(=O)N2CCCCC2)CCNCC1
InChIInChI=1S/C12H22N2O/c1-12(5-7-13-8-6-12)11(15)14-9-3-2-4-10-14/h13H,2-10H2,1H3
InChIKeyIGYSOIGUUNDTBV-UHFFFAOYSA-N
MW210.32 g/mol
LogP1.39
Rot. Bonds1

About (4-methylpiperidin-4-yl)-piperidin-1-ylmethanone

(4-methylpiperidin-4-yl)-piperidin-1-ylmethanone (PubChem CID 24728858) has the molecular formula C12H22N2O and a molecular weight of 210.32 g/mol. Its IUPAC name is (4-methylpiperidin-4-yl)-piperidin-1-ylmethanone.

Molecular Properties

Compound Name(4-methylpiperidin-4-yl)-piperidin-1-ylmethanone
PubChem CID24728858
Molecular FormulaC12H22N2O
Molecular Weight210.32 g/mol
Exact Mass210.17
IUPAC Name(4-methylpiperidin-4-yl)-piperidin-1-ylmethanone
SMILESCC1(C(=O)N2CCCCC2)CCNCC1
InChIInChI=1S/C12H22N2O/c1-12(5-7-13-8-6-12)11(15)14-9-3-2-4-10-14/h13H,2-10H2,1H3
InChIKeyIGYSOIGUUNDTBV-UHFFFAOYSA-N
XLogP1.39
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.32
LogP ≤ 51.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (4-methylpiperidin-4-yl)-piperidin-1-ylmethanone?
The IUPAC name of (4-methylpiperidin-4-yl)-piperidin-1-ylmethanone (CID 24728858) is (4-methylpiperidin-4-yl)-piperidin-1-ylmethanone.
What is the SMILES notation for (4-methylpiperidin-4-yl)-piperidin-1-ylmethanone?
The canonical SMILES for (4-methylpiperidin-4-yl)-piperidin-1-ylmethanone is CC1(C(=O)N2CCCCC2)CCNCC1.
What is the InChIKey of (4-methylpiperidin-4-yl)-piperidin-1-ylmethanone?
The InChIKey is IGYSOIGUUNDTBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N2O/c1-12(5-7-13-8-6-12)11(15)14-9-3-2-4-10-14/h13H,2-10H2,1H3.
What are the key properties of (4-methylpiperidin-4-yl)-piperidin-1-ylmethanone?
(4-methylpiperidin-4-yl)-piperidin-1-ylmethanone has a molecular weight of 210.32 g/mol, XLogP of 1.39, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4-methylpiperidin-4-yl)-piperidin-1-ylmethanone is sourced from PubChem (CID 24728858), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).