1-[(4R)-2-(methoxymethyl)-1-methylpiperidin-4-yl]-2,3-dimethylpiperidine

C15H30N2O — CID 70846890

IUPAC1-[(4R)-2-(methoxymethyl)-1-methylpiperidin-4-yl]-2,3-dimethylpiperidine
SMILESCOCC1C[C@H](N2CCCC(C)C2C)CCN1C
InChIInChI=1S/C15H30N2O/c1-12-6-5-8-17(13(12)2)14-7-9-16(3)15(10-14)11-18-4/h12-15H,5-11H2,1-4H3/t12?,13?,14-,15?/m1/s1
InChIKeySBQUCZSDPSYUCB-MIGSVPMKSA-N
MW254.42 g/mol
LogP2.22
Rot. Bonds3

About 1-[(4R)-2-(methoxymethyl)-1-methylpiperidin-4-yl]-2,3-dimethylpiperidine

1-[(4R)-2-(methoxymethyl)-1-methylpiperidin-4-yl]-2,3-dimethylpiperidine (PubChem CID 70846890) has the molecular formula C15H30N2O and a molecular weight of 254.42 g/mol. Its IUPAC name is 1-[(4R)-2-(methoxymethyl)-1-methylpiperidin-4-yl]-2,3-dimethylpiperidine.

Molecular Properties

Compound Name1-[(4R)-2-(methoxymethyl)-1-methylpiperidin-4-yl]-2,3-dimethylpiperidine
PubChem CID70846890
Molecular FormulaC15H30N2O
Molecular Weight254.42 g/mol
Exact Mass254.24
IUPAC Name1-[(4R)-2-(methoxymethyl)-1-methylpiperidin-4-yl]-2,3-dimethylpiperidine
SMILESCOCC1C[C@H](N2CCCC(C)C2C)CCN1C
InChIInChI=1S/C15H30N2O/c1-12-6-5-8-17(13(12)2)14-7-9-16(3)15(10-14)11-18-4/h12-15H,5-11H2,1-4H3/t12?,13?,14-,15?/m1/s1
InChIKeySBQUCZSDPSYUCB-MIGSVPMKSA-N
XLogP2.22
TPSA15.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.42
LogP ≤ 52.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-[(4R)-2-(methoxymethyl)-1-methylpiperidin-4-yl]-2,3-dimethylpiperidine?
The IUPAC name of 1-[(4R)-2-(methoxymethyl)-1-methylpiperidin-4-yl]-2,3-dimethylpiperidine (CID 70846890) is 1-[(4R)-2-(methoxymethyl)-1-methylpiperidin-4-yl]-2,3-dimethylpiperidine.
What is the SMILES notation for 1-[(4R)-2-(methoxymethyl)-1-methylpiperidin-4-yl]-2,3-dimethylpiperidine?
The canonical SMILES for 1-[(4R)-2-(methoxymethyl)-1-methylpiperidin-4-yl]-2,3-dimethylpiperidine is COCC1C[C@H](N2CCCC(C)C2C)CCN1C.
What is the InChIKey of 1-[(4R)-2-(methoxymethyl)-1-methylpiperidin-4-yl]-2,3-dimethylpiperidine?
The InChIKey is SBQUCZSDPSYUCB-MIGSVPMKSA-N. The full InChI is InChI=1S/C15H30N2O/c1-12-6-5-8-17(13(12)2)14-7-9-16(3)15(10-14)11-18-4/h12-15H,5-11H2,1-4H3/t12?,13?,14-,15?/m1/s1.
What are the key properties of 1-[(4R)-2-(methoxymethyl)-1-methylpiperidin-4-yl]-2,3-dimethylpiperidine?
1-[(4R)-2-(methoxymethyl)-1-methylpiperidin-4-yl]-2,3-dimethylpiperidine has a molecular weight of 254.42 g/mol, XLogP of 2.22, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(4R)-2-(methoxymethyl)-1-methylpiperidin-4-yl]-2,3-dimethylpiperidine is sourced from PubChem (CID 70846890), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).