3-methyl-1-(3-piperidin-4-yloxypropyl)piperidine

C14H28N2O — CID 63904524

IUPAC3-methyl-1-(3-piperidin-4-yloxypropyl)piperidine
SMILESCC1CCCN(CCCOC2CCNCC2)C1
InChIInChI=1S/C14H28N2O/c1-13-4-2-9-16(12-13)10-3-11-17-14-5-7-15-8-6-14/h13-15H,2-12H2,1H3
InChIKeyKWFRMXVBFWMLPW-UHFFFAOYSA-N
MW240.39 g/mol
LogP1.88
Rot. Bonds5

About 3-methyl-1-(3-piperidin-4-yloxypropyl)piperidine

3-methyl-1-(3-piperidin-4-yloxypropyl)piperidine (PubChem CID 63904524) has the molecular formula C14H28N2O and a molecular weight of 240.39 g/mol. Its IUPAC name is 3-methyl-1-(3-piperidin-4-yloxypropyl)piperidine.

Molecular Properties

Compound Name3-methyl-1-(3-piperidin-4-yloxypropyl)piperidine
PubChem CID63904524
Molecular FormulaC14H28N2O
Molecular Weight240.39 g/mol
Exact Mass240.22
IUPAC Name3-methyl-1-(3-piperidin-4-yloxypropyl)piperidine
SMILESCC1CCCN(CCCOC2CCNCC2)C1
InChIInChI=1S/C14H28N2O/c1-13-4-2-9-16(12-13)10-3-11-17-14-5-7-15-8-6-14/h13-15H,2-12H2,1H3
InChIKeyKWFRMXVBFWMLPW-UHFFFAOYSA-N
XLogP1.88
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.39
LogP ≤ 51.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

3-methoxy-1-(3-piperidin-4-yloxypropyl)piperidine
CID 102963853
3-methyl-1-(2-piperidin-4-ylethyl)piperidine;dihydrochloride
CID 56831695
N,N,4-trimethyl-1-(3-piperidin-4-yloxypropyl)pyrrolidin-3-amine
CID 81464896
4-[3-(2,5-dihydropyrrol-1-yl)propoxy]piperidine
CID 65418148
4-[3-(2-cyclopentylpyrrolidin-1-yl)propoxy]piperidine
CID 63903227
4-(3-piperidin-4-yloxypropyl)-1,4-thiazinane 1,1-dioxide
CID 63871035
2-(3-piperidin-4-yloxypropyl)-2-azaspiro[3.3]heptane
CID 79678748
2,3,5-trimethyl-1-(3-piperidin-4-yloxypropyl)piperidine
CID 114593846
1-butyl-3-methylpiperidine;ethane
CID 143349503
1-(3-fluoropropyl)-3-methylpiperidine
CID 127497514
2-(3-piperidin-4-yloxypropyl)-2-azaspiro[3.6]decane
CID 79677564
1-[3-(1-methylazetidin-3-yl)oxypropyl]piperazine
CID 146420488

Frequently Asked Questions

What is the IUPAC name of 3-methyl-1-(3-piperidin-4-yloxypropyl)piperidine?
The IUPAC name of 3-methyl-1-(3-piperidin-4-yloxypropyl)piperidine (CID 63904524) is 3-methyl-1-(3-piperidin-4-yloxypropyl)piperidine.
What is the SMILES notation for 3-methyl-1-(3-piperidin-4-yloxypropyl)piperidine?
The canonical SMILES for 3-methyl-1-(3-piperidin-4-yloxypropyl)piperidine is CC1CCCN(CCCOC2CCNCC2)C1.
What is the InChIKey of 3-methyl-1-(3-piperidin-4-yloxypropyl)piperidine?
The InChIKey is KWFRMXVBFWMLPW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O/c1-13-4-2-9-16(12-13)10-3-11-17-14-5-7-15-8-6-14/h13-15H,2-12H2,1H3.
What are the key properties of 3-methyl-1-(3-piperidin-4-yloxypropyl)piperidine?
3-methyl-1-(3-piperidin-4-yloxypropyl)piperidine has a molecular weight of 240.39 g/mol, XLogP of 1.88, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-1-(3-piperidin-4-yloxypropyl)piperidine is sourced from PubChem (CID 63904524), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).