1-methyl-2-(2-methylpentan-3-yl)piperidine

C12H25N — CID 167033020

IUPAC1-methyl-2-(2-methylpentan-3-yl)piperidine
SMILESCCC(C(C)C)C1CCCCN1C
InChIInChI=1S/C12H25N/c1-5-11(10(2)3)12-8-6-7-9-13(12)4/h10-12H,5-9H2,1-4H3
InChIKeyZDZMDNBBZROOSL-UHFFFAOYSA-N
MW183.34 g/mol
LogP3.15
Rot. Bonds3

About 1-methyl-2-(2-methylpentan-3-yl)piperidine

1-methyl-2-(2-methylpentan-3-yl)piperidine (PubChem CID 167033020) has the molecular formula C12H25N and a molecular weight of 183.34 g/mol. Its IUPAC name is 1-methyl-2-(2-methylpentan-3-yl)piperidine.

Molecular Properties

Compound Name1-methyl-2-(2-methylpentan-3-yl)piperidine
PubChem CID167033020
Molecular FormulaC12H25N
Molecular Weight183.34 g/mol
Exact Mass183.20
IUPAC Name1-methyl-2-(2-methylpentan-3-yl)piperidine
SMILESCCC(C(C)C)C1CCCCN1C
InChIInChI=1S/C12H25N/c1-5-11(10(2)3)12-8-6-7-9-13(12)4/h10-12H,5-9H2,1-4H3
InChIKeyZDZMDNBBZROOSL-UHFFFAOYSA-N
XLogP3.15
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.34
LogP ≤ 53.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-methyl-2-(2-methylpentan-3-yl)piperidine?
The IUPAC name of 1-methyl-2-(2-methylpentan-3-yl)piperidine (CID 167033020) is 1-methyl-2-(2-methylpentan-3-yl)piperidine.
What is the SMILES notation for 1-methyl-2-(2-methylpentan-3-yl)piperidine?
The canonical SMILES for 1-methyl-2-(2-methylpentan-3-yl)piperidine is CCC(C(C)C)C1CCCCN1C.
What is the InChIKey of 1-methyl-2-(2-methylpentan-3-yl)piperidine?
The InChIKey is ZDZMDNBBZROOSL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25N/c1-5-11(10(2)3)12-8-6-7-9-13(12)4/h10-12H,5-9H2,1-4H3.
What are the key properties of 1-methyl-2-(2-methylpentan-3-yl)piperidine?
1-methyl-2-(2-methylpentan-3-yl)piperidine has a molecular weight of 183.34 g/mol, XLogP of 3.15, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-2-(2-methylpentan-3-yl)piperidine is sourced from PubChem (CID 167033020), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).