1,4-dimethylpiperidine;3-methyl-3-azabicyclo[3.2.1]octane

C15H30N2 — CID 176562106

IUPAC1,4-dimethylpiperidine;3-methyl-3-azabicyclo[3.2.1]octane
SMILESCC1CCN(C)CC1.CN1CC2CCC(C2)C1
InChIInChI=1S/C8H15N.C7H15N/c1-9-5-7-2-3-8(4-7)6-9;1-7-3-5-8(2)6-4-7/h7-8H,2-6H2,1H3;7H,3-6H2,1-2H3
InChIKeyJBYIIVPWJKYARN-UHFFFAOYSA-N
MW238.42 g/mol
LogP2.70
Rot. Bonds

About 1,4-dimethylpiperidine;3-methyl-3-azabicyclo[3.2.1]octane

1,4-dimethylpiperidine;3-methyl-3-azabicyclo[3.2.1]octane (PubChem CID 176562106) has the molecular formula C15H30N2 and a molecular weight of 238.42 g/mol. Its IUPAC name is 1,4-dimethylpiperidine;3-methyl-3-azabicyclo[3.2.1]octane.

Molecular Properties

Compound Name1,4-dimethylpiperidine;3-methyl-3-azabicyclo[3.2.1]octane
PubChem CID176562106
Molecular FormulaC15H30N2
Molecular Weight238.42 g/mol
Exact Mass238.24
IUPAC Name1,4-dimethylpiperidine;3-methyl-3-azabicyclo[3.2.1]octane
SMILESCC1CCN(C)CC1.CN1CC2CCC(C2)C1
InChIInChI=1S/C8H15N.C7H15N/c1-9-5-7-2-3-8(4-7)6-9;1-7-3-5-8(2)6-4-7/h7-8H,2-6H2,1H3;7H,3-6H2,1-2H3
InChIKeyJBYIIVPWJKYARN-UHFFFAOYSA-N
XLogP2.70
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.42
LogP ≤ 52.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1,4-dimethylpiperidine;3-methyl-3-azabicyclo[3.2.1]octane?
The IUPAC name of 1,4-dimethylpiperidine;3-methyl-3-azabicyclo[3.2.1]octane (CID 176562106) is 1,4-dimethylpiperidine;3-methyl-3-azabicyclo[3.2.1]octane.
What is the SMILES notation for 1,4-dimethylpiperidine;3-methyl-3-azabicyclo[3.2.1]octane?
The canonical SMILES for 1,4-dimethylpiperidine;3-methyl-3-azabicyclo[3.2.1]octane is CC1CCN(C)CC1.CN1CC2CCC(C2)C1.
What is the InChIKey of 1,4-dimethylpiperidine;3-methyl-3-azabicyclo[3.2.1]octane?
The InChIKey is JBYIIVPWJKYARN-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15N.C7H15N/c1-9-5-7-2-3-8(4-7)6-9;1-7-3-5-8(2)6-4-7/h7-8H,2-6H2,1H3;7H,3-6H2,1-2H3.
What are the key properties of 1,4-dimethylpiperidine;3-methyl-3-azabicyclo[3.2.1]octane?
1,4-dimethylpiperidine;3-methyl-3-azabicyclo[3.2.1]octane has a molecular weight of 238.42 g/mol, XLogP of 2.70, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,4-dimethylpiperidine;3-methyl-3-azabicyclo[3.2.1]octane is sourced from PubChem (CID 176562106), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).