3-methoxy-3-methyl-1-[(4-propylpiperidin-4-yl)methyl]piperidine

C16H32N2O — CID 107393283

IUPAC3-methoxy-3-methyl-1-[(4-propylpiperidin-4-yl)methyl]piperidine
SMILESCCCC1(CN2CCCC(C)(OC)C2)CCNCC1
InChIInChI=1S/C16H32N2O/c1-4-6-16(8-10-17-11-9-16)14-18-12-5-7-15(2,13-18)19-3/h17H,4-14H2,1-3H3
InChIKeySUUMXGOYHKVPGX-UHFFFAOYSA-N
MW268.44 g/mol
LogP2.66
Rot. Bonds5

About 3-methoxy-3-methyl-1-[(4-propylpiperidin-4-yl)methyl]piperidine

3-methoxy-3-methyl-1-[(4-propylpiperidin-4-yl)methyl]piperidine (PubChem CID 107393283) has the molecular formula C16H32N2O and a molecular weight of 268.44 g/mol. Its IUPAC name is 3-methoxy-3-methyl-1-[(4-propylpiperidin-4-yl)methyl]piperidine.

Molecular Properties

Compound Name3-methoxy-3-methyl-1-[(4-propylpiperidin-4-yl)methyl]piperidine
PubChem CID107393283
Molecular FormulaC16H32N2O
Molecular Weight268.44 g/mol
Exact Mass268.25
IUPAC Name3-methoxy-3-methyl-1-[(4-propylpiperidin-4-yl)methyl]piperidine
SMILESCCCC1(CN2CCCC(C)(OC)C2)CCNCC1
InChIInChI=1S/C16H32N2O/c1-4-6-16(8-10-17-11-9-16)14-18-12-5-7-15(2,13-18)19-3/h17H,4-14H2,1-3H3
InChIKeySUUMXGOYHKVPGX-UHFFFAOYSA-N
XLogP2.66
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.44
LogP ≤ 52.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-methoxy-3-methyl-1-[(4-propylpiperidin-4-yl)methyl]piperidine?
The IUPAC name of 3-methoxy-3-methyl-1-[(4-propylpiperidin-4-yl)methyl]piperidine (CID 107393283) is 3-methoxy-3-methyl-1-[(4-propylpiperidin-4-yl)methyl]piperidine.
What is the SMILES notation for 3-methoxy-3-methyl-1-[(4-propylpiperidin-4-yl)methyl]piperidine?
The canonical SMILES for 3-methoxy-3-methyl-1-[(4-propylpiperidin-4-yl)methyl]piperidine is CCCC1(CN2CCCC(C)(OC)C2)CCNCC1.
What is the InChIKey of 3-methoxy-3-methyl-1-[(4-propylpiperidin-4-yl)methyl]piperidine?
The InChIKey is SUUMXGOYHKVPGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32N2O/c1-4-6-16(8-10-17-11-9-16)14-18-12-5-7-15(2,13-18)19-3/h17H,4-14H2,1-3H3.
What are the key properties of 3-methoxy-3-methyl-1-[(4-propylpiperidin-4-yl)methyl]piperidine?
3-methoxy-3-methyl-1-[(4-propylpiperidin-4-yl)methyl]piperidine has a molecular weight of 268.44 g/mol, XLogP of 2.66, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-3-methyl-1-[(4-propylpiperidin-4-yl)methyl]piperidine is sourced from PubChem (CID 107393283), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).