4-(2-methylpropoxymethyl)piperidine

C10H21NO — CID 24692196

IUPAC4-(2-methylpropoxymethyl)piperidine
SMILESCC(C)COCC1CCNCC1
InChIInChI=1S/C10H21NO/c1-9(2)7-12-8-10-3-5-11-6-4-10/h9-11H,3-8H2,1-2H3
InChIKeyFUJUEGHFNHCTIJ-UHFFFAOYSA-N
MW171.28 g/mol
LogP1.66
Rot. Bonds4

About 4-(2-methylpropoxymethyl)piperidine

4-(2-methylpropoxymethyl)piperidine (PubChem CID 24692196) has the molecular formula C10H21NO and a molecular weight of 171.28 g/mol. Its IUPAC name is 4-(2-methylpropoxymethyl)piperidine.

Molecular Properties

Compound Name4-(2-methylpropoxymethyl)piperidine
PubChem CID24692196
Molecular FormulaC10H21NO
Molecular Weight171.28 g/mol
Exact Mass171.16
IUPAC Name4-(2-methylpropoxymethyl)piperidine
SMILESCC(C)COCC1CCNCC1
InChIInChI=1S/C10H21NO/c1-9(2)7-12-8-10-3-5-11-6-4-10/h9-11H,3-8H2,1-2H3
InChIKeyFUJUEGHFNHCTIJ-UHFFFAOYSA-N
XLogP1.66
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.28
LogP ≤ 51.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-(2-methylpropoxymethyl)piperidine?
The IUPAC name of 4-(2-methylpropoxymethyl)piperidine (CID 24692196) is 4-(2-methylpropoxymethyl)piperidine.
What is the SMILES notation for 4-(2-methylpropoxymethyl)piperidine?
The canonical SMILES for 4-(2-methylpropoxymethyl)piperidine is CC(C)COCC1CCNCC1.
What is the InChIKey of 4-(2-methylpropoxymethyl)piperidine?
The InChIKey is FUJUEGHFNHCTIJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NO/c1-9(2)7-12-8-10-3-5-11-6-4-10/h9-11H,3-8H2,1-2H3.
What are the key properties of 4-(2-methylpropoxymethyl)piperidine?
4-(2-methylpropoxymethyl)piperidine has a molecular weight of 171.28 g/mol, XLogP of 1.66, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-methylpropoxymethyl)piperidine is sourced from PubChem (CID 24692196), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).