4-(2-methylpropoxy)piperidine

C9H19NO — CID 11701188

IUPAC4-(2-methylpropoxy)piperidine
SMILESCC(C)COC1CCNCC1
InChIInChI=1S/C9H19NO/c1-8(2)7-11-9-3-5-10-6-4-9/h8-10H,3-7H2,1-2H3
InChIKeyVQCDOLZOAYIDQJ-UHFFFAOYSA-N
MW157.26 g/mol
LogP1.41
Rot. Bonds3

About 4-(2-methylpropoxy)piperidine

4-(2-methylpropoxy)piperidine (PubChem CID 11701188) has the molecular formula C9H19NO and a molecular weight of 157.26 g/mol. Its IUPAC name is 4-(2-methylpropoxy)piperidine.

Molecular Properties

Compound Name4-(2-methylpropoxy)piperidine
PubChem CID11701188
Molecular FormulaC9H19NO
Molecular Weight157.26 g/mol
Exact Mass157.15
IUPAC Name4-(2-methylpropoxy)piperidine
SMILESCC(C)COC1CCNCC1
InChIInChI=1S/C9H19NO/c1-8(2)7-11-9-3-5-10-6-4-9/h8-10H,3-7H2,1-2H3
InChIKeyVQCDOLZOAYIDQJ-UHFFFAOYSA-N
XLogP1.41
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.26
LogP ≤ 51.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-(2-methylpropoxy)piperidine?
The IUPAC name of 4-(2-methylpropoxy)piperidine (CID 11701188) is 4-(2-methylpropoxy)piperidine.
What is the SMILES notation for 4-(2-methylpropoxy)piperidine?
The canonical SMILES for 4-(2-methylpropoxy)piperidine is CC(C)COC1CCNCC1.
What is the InChIKey of 4-(2-methylpropoxy)piperidine?
The InChIKey is VQCDOLZOAYIDQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19NO/c1-8(2)7-11-9-3-5-10-6-4-9/h8-10H,3-7H2,1-2H3.
What are the key properties of 4-(2-methylpropoxy)piperidine?
4-(2-methylpropoxy)piperidine has a molecular weight of 157.26 g/mol, XLogP of 1.41, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-methylpropoxy)piperidine is sourced from PubChem (CID 11701188), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).