1-(4-methoxypiperidin-1-yl)pentan-1-one

C11H21NO2 — CID 110725259

IUPAC1-(4-methoxypiperidin-1-yl)pentan-1-one
SMILESCCCCC(=O)N1CCC(OC)CC1
InChIInChI=1S/C11H21NO2/c1-3-4-5-11(13)12-8-6-10(14-2)7-9-12/h10H,3-9H2,1-2H3
InChIKeyBKDLXTJLTMJGDS-UHFFFAOYSA-N
MW199.29 g/mol
LogP1.81
Rot. Bonds4

About 1-(4-methoxypiperidin-1-yl)pentan-1-one

1-(4-methoxypiperidin-1-yl)pentan-1-one (PubChem CID 110725259) has the molecular formula C11H21NO2 and a molecular weight of 199.29 g/mol. Its IUPAC name is 1-(4-methoxypiperidin-1-yl)pentan-1-one.

Molecular Properties

Compound Name1-(4-methoxypiperidin-1-yl)pentan-1-one
PubChem CID110725259
Molecular FormulaC11H21NO2
Molecular Weight199.29 g/mol
Exact Mass199.16
IUPAC Name1-(4-methoxypiperidin-1-yl)pentan-1-one
SMILESCCCCC(=O)N1CCC(OC)CC1
InChIInChI=1S/C11H21NO2/c1-3-4-5-11(13)12-8-6-10(14-2)7-9-12/h10H,3-9H2,1-2H3
InChIKeyBKDLXTJLTMJGDS-UHFFFAOYSA-N
XLogP1.81
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.29
LogP ≤ 51.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

5-bromo-1-(4-methoxypiperidin-1-yl)pentan-1-one
CID 107908012
3-chloro-1-(4-methoxypiperidin-1-yl)propan-1-one
CID 43373029
1-[4,7,10,13,16-penta(pentanoyl)-1,4,7,10,13,16-hexazacyclooctadec-1-yl]pentan-1-one
CID 603333
1-[4-(2-methoxyethyl)piperidin-1-yl]pentan-1-one
CID 90437878
methyl 1-heptanoylpiperidine-4-carboxylate
CID 43423316
1-(4-methylpiperidin-1-yl)tetradecan-1-one
CID 10425459
1-(4-ethylpiperidin-1-yl)octan-1-one
CID 166490088
1-(4-aminopiperidin-1-yl)nonan-1-one
CID 65449656
1-(3-methoxypyrrolidin-1-yl)pentane-1,4-dione
CID 103533267
1-(4-bromopiperidin-1-yl)decan-1-one
CID 80661862
5-hydroxy-1-(3-methoxypyrrolidin-1-yl)pentan-1-one
CID 19039692
1-[4-(2-aminoethoxy)piperidin-1-yl]decan-1-one
CID 82688423

Frequently Asked Questions

What is the IUPAC name of 1-(4-methoxypiperidin-1-yl)pentan-1-one?
The IUPAC name of 1-(4-methoxypiperidin-1-yl)pentan-1-one (CID 110725259) is 1-(4-methoxypiperidin-1-yl)pentan-1-one.
What is the SMILES notation for 1-(4-methoxypiperidin-1-yl)pentan-1-one?
The canonical SMILES for 1-(4-methoxypiperidin-1-yl)pentan-1-one is CCCCC(=O)N1CCC(OC)CC1.
What is the InChIKey of 1-(4-methoxypiperidin-1-yl)pentan-1-one?
The InChIKey is BKDLXTJLTMJGDS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO2/c1-3-4-5-11(13)12-8-6-10(14-2)7-9-12/h10H,3-9H2,1-2H3.
What are the key properties of 1-(4-methoxypiperidin-1-yl)pentan-1-one?
1-(4-methoxypiperidin-1-yl)pentan-1-one has a molecular weight of 199.29 g/mol, XLogP of 1.81, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-methoxypiperidin-1-yl)pentan-1-one is sourced from PubChem (CID 110725259), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).