2-methyl-1-[2-methyl-5-(2-methylpiperidin-1-yl)pentyl]piperidine

C18H36N2 — CID 21465774

IUPAC2-methyl-1-[2-methyl-5-(2-methylpiperidin-1-yl)pentyl]piperidine
SMILESCC(CCCN1CCCCC1C)CN1CCCCC1C
InChIInChI=1S/C18H36N2/c1-16(15-20-13-7-5-11-18(20)3)9-8-14-19-12-6-4-10-17(19)2/h16-18H,4-15H2,1-3H3
InChIKeyXBXOLHNUQPBYIC-UHFFFAOYSA-N
MW280.50 g/mol
LogP4.15
Rot. Bonds6

About 2-methyl-1-[2-methyl-5-(2-methylpiperidin-1-yl)pentyl]piperidine

2-methyl-1-[2-methyl-5-(2-methylpiperidin-1-yl)pentyl]piperidine (PubChem CID 21465774) has the molecular formula C18H36N2 and a molecular weight of 280.50 g/mol. Its IUPAC name is 2-methyl-1-[2-methyl-5-(2-methylpiperidin-1-yl)pentyl]piperidine.

Molecular Properties

Compound Name2-methyl-1-[2-methyl-5-(2-methylpiperidin-1-yl)pentyl]piperidine
PubChem CID21465774
Molecular FormulaC18H36N2
Molecular Weight280.50 g/mol
Exact Mass280.29
IUPAC Name2-methyl-1-[2-methyl-5-(2-methylpiperidin-1-yl)pentyl]piperidine
SMILESCC(CCCN1CCCCC1C)CN1CCCCC1C
InChIInChI=1S/C18H36N2/c1-16(15-20-13-7-5-11-18(20)3)9-8-14-19-12-6-4-10-17(19)2/h16-18H,4-15H2,1-3H3
InChIKeyXBXOLHNUQPBYIC-UHFFFAOYSA-N
XLogP4.15
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.50
LogP ≤ 54.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-1-[2-methyl-5-(2-methylpiperidin-1-yl)pentyl]piperidine?
The IUPAC name of 2-methyl-1-[2-methyl-5-(2-methylpiperidin-1-yl)pentyl]piperidine (CID 21465774) is 2-methyl-1-[2-methyl-5-(2-methylpiperidin-1-yl)pentyl]piperidine.
What is the SMILES notation for 2-methyl-1-[2-methyl-5-(2-methylpiperidin-1-yl)pentyl]piperidine?
The canonical SMILES for 2-methyl-1-[2-methyl-5-(2-methylpiperidin-1-yl)pentyl]piperidine is CC(CCCN1CCCCC1C)CN1CCCCC1C.
What is the InChIKey of 2-methyl-1-[2-methyl-5-(2-methylpiperidin-1-yl)pentyl]piperidine?
The InChIKey is XBXOLHNUQPBYIC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H36N2/c1-16(15-20-13-7-5-11-18(20)3)9-8-14-19-12-6-4-10-17(19)2/h16-18H,4-15H2,1-3H3.
What are the key properties of 2-methyl-1-[2-methyl-5-(2-methylpiperidin-1-yl)pentyl]piperidine?
2-methyl-1-[2-methyl-5-(2-methylpiperidin-1-yl)pentyl]piperidine has a molecular weight of 280.50 g/mol, XLogP of 4.15, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-1-[2-methyl-5-(2-methylpiperidin-1-yl)pentyl]piperidine is sourced from PubChem (CID 21465774), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).