4-[(3,3-diethylazetidin-1-yl)methyl]-4-(methoxymethyl)piperidine

C15H30N2O — CID 114280638

IUPAC4-[(3,3-diethylazetidin-1-yl)methyl]-4-(methoxymethyl)piperidine
SMILESCCC1(CC)CN(CC2(COC)CCNCC2)C1
InChIInChI=1S/C15H30N2O/c1-4-14(5-2)10-17(11-14)12-15(13-18-3)6-8-16-9-7-15/h16H,4-13H2,1-3H3
InChIKeyAASWRVUCQDZFFS-UHFFFAOYSA-N
MW254.42 g/mol
LogP2.12
Rot. Bonds6

About 4-[(3,3-diethylazetidin-1-yl)methyl]-4-(methoxymethyl)piperidine

4-[(3,3-diethylazetidin-1-yl)methyl]-4-(methoxymethyl)piperidine (PubChem CID 114280638) has the molecular formula C15H30N2O and a molecular weight of 254.42 g/mol. Its IUPAC name is 4-[(3,3-diethylazetidin-1-yl)methyl]-4-(methoxymethyl)piperidine.

Molecular Properties

Compound Name4-[(3,3-diethylazetidin-1-yl)methyl]-4-(methoxymethyl)piperidine
PubChem CID114280638
Molecular FormulaC15H30N2O
Molecular Weight254.42 g/mol
Exact Mass254.24
IUPAC Name4-[(3,3-diethylazetidin-1-yl)methyl]-4-(methoxymethyl)piperidine
SMILESCCC1(CC)CN(CC2(COC)CCNCC2)C1
InChIInChI=1S/C15H30N2O/c1-4-14(5-2)10-17(11-14)12-15(13-18-3)6-8-16-9-7-15/h16H,4-13H2,1-3H3
InChIKeyAASWRVUCQDZFFS-UHFFFAOYSA-N
XLogP2.12
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.42
LogP ≤ 52.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(2R,6S)-4-[[4-(methoxymethyl)piperidin-4-yl]methyl]-2,6-dimethylmorpholine
CID 114042172
4-(methoxymethyl)-4-[(3-propylpyrrolidin-1-yl)methyl]piperidine
CID 114042162
1-[(4-ethylpiperidin-4-yl)methyl]-4-methoxypiperidine
CID 55177605
[4-(methoxymethyl)piperidin-4-yl]methanol;hydrochloride
CID 126569824
4,4-diethylpiperidine;hydrochloride
CID 75419509
1-ethyl-1-(methoxymethyl)cyclopropane
CID 23568583
1-[(4-ethylpiperidin-4-yl)methyl]-4-methylpiperidine
CID 63129487
4-[(4-ethylpiperidin-4-yl)methyl]-1,4-thiazinane 1-oxide
CID 63129878
1-[(3-ethylpyrrolidin-3-yl)methyl]-4-(methoxymethyl)piperidine
CID 63979218
2-[(4-ethylpiperidin-4-yl)methyl]-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrole
CID 113335807
3-ethyl-3-(methoxymethyl)-1-methylpyrrolidine
CID 130347228
4-[(4-ethylpiperidin-4-yl)methyl]-1,4-thiazepane
CID 63129326

Frequently Asked Questions

What is the IUPAC name of 4-[(3,3-diethylazetidin-1-yl)methyl]-4-(methoxymethyl)piperidine?
The IUPAC name of 4-[(3,3-diethylazetidin-1-yl)methyl]-4-(methoxymethyl)piperidine (CID 114280638) is 4-[(3,3-diethylazetidin-1-yl)methyl]-4-(methoxymethyl)piperidine.
What is the SMILES notation for 4-[(3,3-diethylazetidin-1-yl)methyl]-4-(methoxymethyl)piperidine?
The canonical SMILES for 4-[(3,3-diethylazetidin-1-yl)methyl]-4-(methoxymethyl)piperidine is CCC1(CC)CN(CC2(COC)CCNCC2)C1.
What is the InChIKey of 4-[(3,3-diethylazetidin-1-yl)methyl]-4-(methoxymethyl)piperidine?
The InChIKey is AASWRVUCQDZFFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2O/c1-4-14(5-2)10-17(11-14)12-15(13-18-3)6-8-16-9-7-15/h16H,4-13H2,1-3H3.
What are the key properties of 4-[(3,3-diethylazetidin-1-yl)methyl]-4-(methoxymethyl)piperidine?
4-[(3,3-diethylazetidin-1-yl)methyl]-4-(methoxymethyl)piperidine has a molecular weight of 254.42 g/mol, XLogP of 2.12, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(3,3-diethylazetidin-1-yl)methyl]-4-(methoxymethyl)piperidine is sourced from PubChem (CID 114280638), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).