3-methyl-1-(4-propan-2-ylpiperidin-4-yl)piperidine

C14H28N2 — CID 165465526

IUPAC3-methyl-1-(4-propan-2-ylpiperidin-4-yl)piperidine
SMILESCC1CCCN(C2(C(C)C)CCNCC2)C1
InChIInChI=1S/C14H28N2/c1-12(2)14(6-8-15-9-7-14)16-10-4-5-13(3)11-16/h12-13,15H,4-11H2,1-3H3
InChIKeyQCVONKCUUKOXPW-UHFFFAOYSA-N
MW224.39 g/mol
LogP2.50
Rot. Bonds2

About 3-methyl-1-(4-propan-2-ylpiperidin-4-yl)piperidine

3-methyl-1-(4-propan-2-ylpiperidin-4-yl)piperidine (PubChem CID 165465526) has the molecular formula C14H28N2 and a molecular weight of 224.39 g/mol. Its IUPAC name is 3-methyl-1-(4-propan-2-ylpiperidin-4-yl)piperidine.

Molecular Properties

Compound Name3-methyl-1-(4-propan-2-ylpiperidin-4-yl)piperidine
PubChem CID165465526
Molecular FormulaC14H28N2
Molecular Weight224.39 g/mol
Exact Mass224.23
IUPAC Name3-methyl-1-(4-propan-2-ylpiperidin-4-yl)piperidine
SMILESCC1CCCN(C2(C(C)C)CCNCC2)C1
InChIInChI=1S/C14H28N2/c1-12(2)14(6-8-15-9-7-14)16-10-4-5-13(3)11-16/h12-13,15H,4-11H2,1-3H3
InChIKeyQCVONKCUUKOXPW-UHFFFAOYSA-N
XLogP2.50
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.39
LogP ≤ 52.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-methyl-1-(4-propan-2-ylpiperidin-4-yl)piperidine?
The IUPAC name of 3-methyl-1-(4-propan-2-ylpiperidin-4-yl)piperidine (CID 165465526) is 3-methyl-1-(4-propan-2-ylpiperidin-4-yl)piperidine.
What is the SMILES notation for 3-methyl-1-(4-propan-2-ylpiperidin-4-yl)piperidine?
The canonical SMILES for 3-methyl-1-(4-propan-2-ylpiperidin-4-yl)piperidine is CC1CCCN(C2(C(C)C)CCNCC2)C1.
What is the InChIKey of 3-methyl-1-(4-propan-2-ylpiperidin-4-yl)piperidine?
The InChIKey is QCVONKCUUKOXPW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2/c1-12(2)14(6-8-15-9-7-14)16-10-4-5-13(3)11-16/h12-13,15H,4-11H2,1-3H3.
What are the key properties of 3-methyl-1-(4-propan-2-ylpiperidin-4-yl)piperidine?
3-methyl-1-(4-propan-2-ylpiperidin-4-yl)piperidine has a molecular weight of 224.39 g/mol, XLogP of 2.50, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-1-(4-propan-2-ylpiperidin-4-yl)piperidine is sourced from PubChem (CID 165465526), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).