1-ethyl-3-(2-methylbutyl)piperidine

C12H25N — CID 3016925

IUPAC1-ethyl-3-(2-methylbutyl)piperidine
SMILESCCC(C)CC1CCCN(CC)C1
InChIInChI=1S/C12H25N/c1-4-11(3)9-12-7-6-8-13(5-2)10-12/h11-12H,4-10H2,1-3H3
InChIKeyDYZADDXQHPDPNW-UHFFFAOYSA-N
MW183.34 g/mol
LogP3.15
Rot. Bonds4

About 1-ethyl-3-(2-methylbutyl)piperidine

1-ethyl-3-(2-methylbutyl)piperidine (PubChem CID 3016925) has the molecular formula C12H25N and a molecular weight of 183.34 g/mol. Its IUPAC name is 1-ethyl-3-(2-methylbutyl)piperidine.

Molecular Properties

Compound Name1-ethyl-3-(2-methylbutyl)piperidine
PubChem CID3016925
Molecular FormulaC12H25N
Molecular Weight183.34 g/mol
Exact Mass183.20
IUPAC Name1-ethyl-3-(2-methylbutyl)piperidine
SMILESCCC(C)CC1CCCN(CC)C1
InChIInChI=1S/C12H25N/c1-4-11(3)9-12-7-6-8-13(5-2)10-12/h11-12H,4-10H2,1-3H3
InChIKeyDYZADDXQHPDPNW-UHFFFAOYSA-N
XLogP3.15
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
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-ethyl-3-(2-methylbutyl)piperidine?
The IUPAC name of 1-ethyl-3-(2-methylbutyl)piperidine (CID 3016925) is 1-ethyl-3-(2-methylbutyl)piperidine.
What is the SMILES notation for 1-ethyl-3-(2-methylbutyl)piperidine?
The canonical SMILES for 1-ethyl-3-(2-methylbutyl)piperidine is CCC(C)CC1CCCN(CC)C1.
What is the InChIKey of 1-ethyl-3-(2-methylbutyl)piperidine?
The InChIKey is DYZADDXQHPDPNW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25N/c1-4-11(3)9-12-7-6-8-13(5-2)10-12/h11-12H,4-10H2,1-3H3.
What are the key properties of 1-ethyl-3-(2-methylbutyl)piperidine?
1-ethyl-3-(2-methylbutyl)piperidine has a molecular weight of 183.34 g/mol, XLogP of 3.15, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-3-(2-methylbutyl)piperidine is sourced from PubChem (CID 3016925), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).