1-cyclopentyl-4-(methoxymethyl)piperidine;ethane

C14H29NO — CID 156885673

IUPAC1-cyclopentyl-4-(methoxymethyl)piperidine;ethane
SMILESCC.COCC1CCN(C2CCCC2)CC1
InChIInChI=1S/C12H23NO.C2H6/c1-14-10-11-6-8-13(9-7-11)12-4-2-3-5-12;1-2/h11-12H,2-10H2,1H3;1-2H3
InChIKeyDIJPAEVSVNAULW-UHFFFAOYSA-N
MW227.39 g/mol
LogP3.31
Rot. Bonds3

About 1-cyclopentyl-4-(methoxymethyl)piperidine;ethane

1-cyclopentyl-4-(methoxymethyl)piperidine;ethane (PubChem CID 156885673) has the molecular formula C14H29NO and a molecular weight of 227.39 g/mol. Its IUPAC name is 1-cyclopentyl-4-(methoxymethyl)piperidine;ethane.

Molecular Properties

Compound Name1-cyclopentyl-4-(methoxymethyl)piperidine;ethane
PubChem CID156885673
Molecular FormulaC14H29NO
Molecular Weight227.39 g/mol
Exact Mass227.22
IUPAC Name1-cyclopentyl-4-(methoxymethyl)piperidine;ethane
SMILESCC.COCC1CCN(C2CCCC2)CC1
InChIInChI=1S/C12H23NO.C2H6/c1-14-10-11-6-8-13(9-7-11)12-4-2-3-5-12;1-2/h11-12H,2-10H2,1H3;1-2H3
InChIKeyDIJPAEVSVNAULW-UHFFFAOYSA-N
XLogP3.31
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.39
LogP ≤ 53.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

(1-Isopropylpiperidin-4-Yl)Methanol
CID 11147855
1-(2-Fluoro-2-methylpropyl)-4-(methoxymethyl)piperidine
CID 126749522
1-Cyclopentyl-4-fluoro-4-[(2-methylpropan-2-yl)oxymethyl]piperidine
CID 159344802
4-(Ethoxymethyl)-4-fluoro-1-propan-2-ylpiperidine
CID 166535225
4-Fluoro-4-(methoxymethyl)-1-propan-2-ylpiperidine
CID 167239675
4-[[(2R)-2-fluoro-4-methylpentoxy]methyl]-1-propan-2-ylpiperidine
CID 168085331
4-(4-Methylpiperidin-1-yl)butyl hypofluorite
CID 174317127
4-(Methoxymethyl)-1,2,6-trimethylpiperidine
CID 20641648
4-(Ethoxymethyl)-1-methylpiperidine
CID 20719704
(1-Pentan-3-ylpiperidin-4-yl)methanol
CID 20735184
4-(Methoxymethyl)-1-methyl-piperidine
CID 20820183
N-methyl-N-(oxan-4-ylmethyl)propan-2-amine
CID 21034340

Frequently Asked Questions

What is the IUPAC name of 1-cyclopentyl-4-(methoxymethyl)piperidine;ethane?
The IUPAC name of 1-cyclopentyl-4-(methoxymethyl)piperidine;ethane (CID 156885673) is 1-cyclopentyl-4-(methoxymethyl)piperidine;ethane.
What is the SMILES notation for 1-cyclopentyl-4-(methoxymethyl)piperidine;ethane?
The canonical SMILES for 1-cyclopentyl-4-(methoxymethyl)piperidine;ethane is CC.COCC1CCN(C2CCCC2)CC1.
What is the InChIKey of 1-cyclopentyl-4-(methoxymethyl)piperidine;ethane?
The InChIKey is DIJPAEVSVNAULW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23NO.C2H6/c1-14-10-11-6-8-13(9-7-11)12-4-2-3-5-12;1-2/h11-12H,2-10H2,1H3;1-2H3.
What are the key properties of 1-cyclopentyl-4-(methoxymethyl)piperidine;ethane?
1-cyclopentyl-4-(methoxymethyl)piperidine;ethane has a molecular weight of 227.39 g/mol, XLogP of 3.31, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentyl-4-(methoxymethyl)piperidine;ethane is sourced from PubChem (CID 156885673), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).