3-methoxy-1-[(4-propylpiperidin-4-yl)methyl]piperidine

C15H30N2O — CID 102963889

IUPAC3-methoxy-1-[(4-propylpiperidin-4-yl)methyl]piperidine
SMILESCCCC1(CN2CCCC(OC)C2)CCNCC1
InChIInChI=1S/C15H30N2O/c1-3-6-15(7-9-16-10-8-15)13-17-11-4-5-14(12-17)18-2/h14,16H,3-13H2,1-2H3
InChIKeyZEOQZRNAKWOWOW-UHFFFAOYSA-N
MW254.42 g/mol
LogP2.27
Rot. Bonds5

About 3-methoxy-1-[(4-propylpiperidin-4-yl)methyl]piperidine

3-methoxy-1-[(4-propylpiperidin-4-yl)methyl]piperidine (PubChem CID 102963889) has the molecular formula C15H30N2O and a molecular weight of 254.42 g/mol. Its IUPAC name is 3-methoxy-1-[(4-propylpiperidin-4-yl)methyl]piperidine.

Molecular Properties

Compound Name3-methoxy-1-[(4-propylpiperidin-4-yl)methyl]piperidine
PubChem CID102963889
Molecular FormulaC15H30N2O
Molecular Weight254.42 g/mol
Exact Mass254.24
IUPAC Name3-methoxy-1-[(4-propylpiperidin-4-yl)methyl]piperidine
SMILESCCCC1(CN2CCCC(OC)C2)CCNCC1
InChIInChI=1S/C15H30N2O/c1-3-6-15(7-9-16-10-8-15)13-17-11-4-5-14(12-17)18-2/h14,16H,3-13H2,1-2H3
InChIKeyZEOQZRNAKWOWOW-UHFFFAOYSA-N
XLogP2.27
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.42
LogP ≤ 52.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[(3-ethylpyrrolidin-3-yl)methyl]-3-methoxypiperidine
CID 102963677
1-[(4-ethylpiperidin-4-yl)methyl]-3-propoxypiperidine
CID 63129663
4-[(3-ethylpyrrolidin-1-yl)methyl]-4-propylpiperidine
CID 113417902
2-[1-[(3-methoxypiperidin-1-yl)methyl]cyclopropyl]acetic acid
CID 102968613
3-methoxy-3-methyl-1-[(4-propylpiperidin-4-yl)methyl]piperidine
CID 107393283
N-[[1-[(3-methoxypiperidin-1-yl)methyl]cycloheptyl]methyl]propan-1-amine
CID 102967363
1-[(4-ethylpiperidin-4-yl)methyl]-4-methoxypiperidine
CID 55177605
N,N-dimethyl-1-[(4-propylpiperidin-4-yl)methyl]piperidin-4-amine
CID 63129344
(3S)-3-methoxy-1-[[1-(propan-2-yloxymethyl)cyclopropyl]methyl]piperidine
CID 170926000
N-[[1-[(3-methoxypiperidin-1-yl)methyl]cyclopentyl]methyl]propan-2-amine
CID 102967390
2-methyl-4-[(4-propylpiperidin-4-yl)methyl]morpholine
CID 63129544
4-[(4-propylpiperidin-4-yl)methyl]-1,4-oxazepane
CID 63129768

Frequently Asked Questions

What is the IUPAC name of 3-methoxy-1-[(4-propylpiperidin-4-yl)methyl]piperidine?
The IUPAC name of 3-methoxy-1-[(4-propylpiperidin-4-yl)methyl]piperidine (CID 102963889) is 3-methoxy-1-[(4-propylpiperidin-4-yl)methyl]piperidine.
What is the SMILES notation for 3-methoxy-1-[(4-propylpiperidin-4-yl)methyl]piperidine?
The canonical SMILES for 3-methoxy-1-[(4-propylpiperidin-4-yl)methyl]piperidine is CCCC1(CN2CCCC(OC)C2)CCNCC1.
What is the InChIKey of 3-methoxy-1-[(4-propylpiperidin-4-yl)methyl]piperidine?
The InChIKey is ZEOQZRNAKWOWOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2O/c1-3-6-15(7-9-16-10-8-15)13-17-11-4-5-14(12-17)18-2/h14,16H,3-13H2,1-2H3.
What are the key properties of 3-methoxy-1-[(4-propylpiperidin-4-yl)methyl]piperidine?
3-methoxy-1-[(4-propylpiperidin-4-yl)methyl]piperidine has a molecular weight of 254.42 g/mol, XLogP of 2.27, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-1-[(4-propylpiperidin-4-yl)methyl]piperidine is sourced from PubChem (CID 102963889), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).