2-ethyl-4-methyl-1-propan-2-ylpiperidine

C11H23N — CID 171506462

IUPAC2-ethyl-4-methyl-1-propan-2-ylpiperidine
SMILESCCC1CC(C)CCN1C(C)C
InChIInChI=1S/C11H23N/c1-5-11-8-10(4)6-7-12(11)9(2)3/h9-11H,5-8H2,1-4H3
InChIKeyYOIYZBIFUGADGD-UHFFFAOYSA-N
MW169.31 g/mol
LogP2.91
Rot. Bonds2

About 2-ethyl-4-methyl-1-propan-2-ylpiperidine

2-ethyl-4-methyl-1-propan-2-ylpiperidine (PubChem CID 171506462) has the molecular formula C11H23N and a molecular weight of 169.31 g/mol. Its IUPAC name is 2-ethyl-4-methyl-1-propan-2-ylpiperidine.

Molecular Properties

Compound Name2-ethyl-4-methyl-1-propan-2-ylpiperidine
PubChem CID171506462
Molecular FormulaC11H23N
Molecular Weight169.31 g/mol
Exact Mass169.18
IUPAC Name2-ethyl-4-methyl-1-propan-2-ylpiperidine
SMILESCCC1CC(C)CCN1C(C)C
InChIInChI=1S/C11H23N/c1-5-11-8-10(4)6-7-12(11)9(2)3/h9-11H,5-8H2,1-4H3
InChIKeyYOIYZBIFUGADGD-UHFFFAOYSA-N
XLogP2.91
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.31
LogP ≤ 52.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-ethyl-4-methyl-1-propan-2-ylpiperidine?
The IUPAC name of 2-ethyl-4-methyl-1-propan-2-ylpiperidine (CID 171506462) is 2-ethyl-4-methyl-1-propan-2-ylpiperidine.
What is the SMILES notation for 2-ethyl-4-methyl-1-propan-2-ylpiperidine?
The canonical SMILES for 2-ethyl-4-methyl-1-propan-2-ylpiperidine is CCC1CC(C)CCN1C(C)C.
What is the InChIKey of 2-ethyl-4-methyl-1-propan-2-ylpiperidine?
The InChIKey is YOIYZBIFUGADGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23N/c1-5-11-8-10(4)6-7-12(11)9(2)3/h9-11H,5-8H2,1-4H3.
What are the key properties of 2-ethyl-4-methyl-1-propan-2-ylpiperidine?
2-ethyl-4-methyl-1-propan-2-ylpiperidine has a molecular weight of 169.31 g/mol, XLogP of 2.91, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-4-methyl-1-propan-2-ylpiperidine is sourced from PubChem (CID 171506462), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).