(3-methoxy-3-methylpiperidin-1-yl)-(6-methylpiperidin-3-yl)methanone

C14H26N2O2 — CID 107392804

IUPAC(3-methoxy-3-methylpiperidin-1-yl)-(6-methylpiperidin-3-yl)methanone
SMILESCOC1(C)CCCN(C(=O)C2CCC(C)NC2)C1
InChIInChI=1S/C14H26N2O2/c1-11-5-6-12(9-15-11)13(17)16-8-4-7-14(2,10-16)18-3/h11-12,15H,4-10H2,1-3H3
InChIKeyZQGMMXSUTBNVSU-UHFFFAOYSA-N
MW254.37 g/mol
LogP1.40
Rot. Bonds2

About (3-methoxy-3-methylpiperidin-1-yl)-(6-methylpiperidin-3-yl)methanone

(3-methoxy-3-methylpiperidin-1-yl)-(6-methylpiperidin-3-yl)methanone (PubChem CID 107392804) has the molecular formula C14H26N2O2 and a molecular weight of 254.37 g/mol. Its IUPAC name is (3-methoxy-3-methylpiperidin-1-yl)-(6-methylpiperidin-3-yl)methanone.

Molecular Properties

Compound Name(3-methoxy-3-methylpiperidin-1-yl)-(6-methylpiperidin-3-yl)methanone
PubChem CID107392804
Molecular FormulaC14H26N2O2
Molecular Weight254.37 g/mol
Exact Mass254.20
IUPAC Name(3-methoxy-3-methylpiperidin-1-yl)-(6-methylpiperidin-3-yl)methanone
SMILESCOC1(C)CCCN(C(=O)C2CCC(C)NC2)C1
InChIInChI=1S/C14H26N2O2/c1-11-5-6-12(9-15-11)13(17)16-8-4-7-14(2,10-16)18-3/h11-12,15H,4-10H2,1-3H3
InChIKeyZQGMMXSUTBNVSU-UHFFFAOYSA-N
XLogP1.40
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.37
LogP ≤ 51.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (3-methoxy-3-methylpiperidin-1-yl)-(6-methylpiperidin-3-yl)methanone?
The IUPAC name of (3-methoxy-3-methylpiperidin-1-yl)-(6-methylpiperidin-3-yl)methanone (CID 107392804) is (3-methoxy-3-methylpiperidin-1-yl)-(6-methylpiperidin-3-yl)methanone.
What is the SMILES notation for (3-methoxy-3-methylpiperidin-1-yl)-(6-methylpiperidin-3-yl)methanone?
The canonical SMILES for (3-methoxy-3-methylpiperidin-1-yl)-(6-methylpiperidin-3-yl)methanone is COC1(C)CCCN(C(=O)C2CCC(C)NC2)C1.
What is the InChIKey of (3-methoxy-3-methylpiperidin-1-yl)-(6-methylpiperidin-3-yl)methanone?
The InChIKey is ZQGMMXSUTBNVSU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2O2/c1-11-5-6-12(9-15-11)13(17)16-8-4-7-14(2,10-16)18-3/h11-12,15H,4-10H2,1-3H3.
What are the key properties of (3-methoxy-3-methylpiperidin-1-yl)-(6-methylpiperidin-3-yl)methanone?
(3-methoxy-3-methylpiperidin-1-yl)-(6-methylpiperidin-3-yl)methanone has a molecular weight of 254.37 g/mol, XLogP of 1.40, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3-methoxy-3-methylpiperidin-1-yl)-(6-methylpiperidin-3-yl)methanone is sourced from PubChem (CID 107392804), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).