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

C15H30N2O — CID 114042162

IUPAC4-(methoxymethyl)-4-[(3-propylpyrrolidin-1-yl)methyl]piperidine
SMILESCCCC1CCN(CC2(COC)CCNCC2)C1
InChIInChI=1S/C15H30N2O/c1-3-4-14-5-10-17(11-14)12-15(13-18-2)6-8-16-9-7-15/h14,16H,3-13H2,1-2H3
InChIKeyMHVMYVVWWRUARA-UHFFFAOYSA-N
MW254.42 g/mol
LogP2.12
Rot. Bonds6

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

4-(methoxymethyl)-4-[(3-propylpyrrolidin-1-yl)methyl]piperidine (PubChem CID 114042162) has the molecular formula C15H30N2O and a molecular weight of 254.42 g/mol. Its IUPAC name is 4-(methoxymethyl)-4-[(3-propylpyrrolidin-1-yl)methyl]piperidine.

Molecular Properties

Compound Name4-(methoxymethyl)-4-[(3-propylpyrrolidin-1-yl)methyl]piperidine
PubChem CID114042162
Molecular FormulaC15H30N2O
Molecular Weight254.42 g/mol
Exact Mass254.24
IUPAC Name4-(methoxymethyl)-4-[(3-propylpyrrolidin-1-yl)methyl]piperidine
SMILESCCCC1CCN(CC2(COC)CCNCC2)C1
InChIInChI=1S/C15H30N2O/c1-3-4-14-5-10-17(11-14)12-15(13-18-2)6-8-16-9-7-15/h14,16H,3-13H2,1-2H3
InChIKeyMHVMYVVWWRUARA-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

4-[(3-ethylpyrrolidin-1-yl)methyl]-4-propylpiperidine
CID 113417902
4-[(3,3-diethylazetidin-1-yl)methyl]-4-(methoxymethyl)piperidine
CID 114280638
(2R,6S)-4-[[4-(methoxymethyl)piperidin-4-yl]methyl]-2,6-dimethylmorpholine
CID 114042172
[1-[(3-propylpyrrolidin-1-yl)methyl]cyclohexyl]methanamine
CID 113417909
1-[(3-ethylpyrrolidin-3-yl)methyl]-4-(methoxymethyl)piperidine
CID 63979218
1-[(4-ethylpiperidin-4-yl)methyl]-4-methoxypiperidine
CID 55177605
3-(methoxymethyl)-1-[(3-methylpyrrolidin-3-yl)methyl]pyrrolidine
CID 64596729
3-methoxy-1-[(4-propylpiperidin-4-yl)methyl]piperidine
CID 102963889
1-ethyl-3-propylpyrrolidine;hydrochloride
CID 175849509
N-[[1-[[3-(methoxymethyl)pyrrolidin-1-yl]methyl]cyclohexyl]methyl]propan-1-amine
CID 64581384
[1-[[3-(methoxymethyl)pyrrolidin-1-yl]methyl]cyclopropyl]methanamine
CID 115453905
3-(2,2-dimethylpropyl)-1-[[1-(methoxymethyl)cyclopropyl]methyl]azetidine
CID 170276303

Frequently Asked Questions

What is the IUPAC name of 4-(methoxymethyl)-4-[(3-propylpyrrolidin-1-yl)methyl]piperidine?
The IUPAC name of 4-(methoxymethyl)-4-[(3-propylpyrrolidin-1-yl)methyl]piperidine (CID 114042162) is 4-(methoxymethyl)-4-[(3-propylpyrrolidin-1-yl)methyl]piperidine.
What is the SMILES notation for 4-(methoxymethyl)-4-[(3-propylpyrrolidin-1-yl)methyl]piperidine?
The canonical SMILES for 4-(methoxymethyl)-4-[(3-propylpyrrolidin-1-yl)methyl]piperidine is CCCC1CCN(CC2(COC)CCNCC2)C1.
What is the InChIKey of 4-(methoxymethyl)-4-[(3-propylpyrrolidin-1-yl)methyl]piperidine?
The InChIKey is MHVMYVVWWRUARA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2O/c1-3-4-14-5-10-17(11-14)12-15(13-18-2)6-8-16-9-7-15/h14,16H,3-13H2,1-2H3.
What are the key properties of 4-(methoxymethyl)-4-[(3-propylpyrrolidin-1-yl)methyl]piperidine?
4-(methoxymethyl)-4-[(3-propylpyrrolidin-1-yl)methyl]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-(methoxymethyl)-4-[(3-propylpyrrolidin-1-yl)methyl]piperidine is sourced from PubChem (CID 114042162), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).