2-methylidene-1-(5-methyloctan-3-yl)piperidine

C15H29N — CID 166989856

IUPAC2-methylidene-1-(5-methyloctan-3-yl)piperidine
SMILESC=C1CCCCN1C(CC)CC(C)CCC
InChIInChI=1S/C15H29N/c1-5-9-13(3)12-15(6-2)16-11-8-7-10-14(16)4/h13,15H,4-12H2,1-3H3
InChIKeyIHHIKGRMUNBGLP-UHFFFAOYSA-N
MW223.40 g/mol
LogP4.59
Rot. Bonds6

About 2-methylidene-1-(5-methyloctan-3-yl)piperidine

2-methylidene-1-(5-methyloctan-3-yl)piperidine (PubChem CID 166989856) has the molecular formula C15H29N and a molecular weight of 223.40 g/mol. Its IUPAC name is 2-methylidene-1-(5-methyloctan-3-yl)piperidine.

Molecular Properties

Compound Name2-methylidene-1-(5-methyloctan-3-yl)piperidine
PubChem CID166989856
Molecular FormulaC15H29N
Molecular Weight223.40 g/mol
Exact Mass223.23
IUPAC Name2-methylidene-1-(5-methyloctan-3-yl)piperidine
SMILESC=C1CCCCN1C(CC)CC(C)CCC
InChIInChI=1S/C15H29N/c1-5-9-13(3)12-15(6-2)16-11-8-7-10-14(16)4/h13,15H,4-12H2,1-3H3
InChIKeyIHHIKGRMUNBGLP-UHFFFAOYSA-N
XLogP4.59
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.40
LogP ≤ 54.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-methylidene-1-(5-methyloctan-3-yl)piperidine?
The IUPAC name of 2-methylidene-1-(5-methyloctan-3-yl)piperidine (CID 166989856) is 2-methylidene-1-(5-methyloctan-3-yl)piperidine.
What is the SMILES notation for 2-methylidene-1-(5-methyloctan-3-yl)piperidine?
The canonical SMILES for 2-methylidene-1-(5-methyloctan-3-yl)piperidine is C=C1CCCCN1C(CC)CC(C)CCC.
What is the InChIKey of 2-methylidene-1-(5-methyloctan-3-yl)piperidine?
The InChIKey is IHHIKGRMUNBGLP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29N/c1-5-9-13(3)12-15(6-2)16-11-8-7-10-14(16)4/h13,15H,4-12H2,1-3H3.
What are the key properties of 2-methylidene-1-(5-methyloctan-3-yl)piperidine?
2-methylidene-1-(5-methyloctan-3-yl)piperidine has a molecular weight of 223.40 g/mol, XLogP of 4.59, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methylidene-1-(5-methyloctan-3-yl)piperidine is sourced from PubChem (CID 166989856), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).