(4-methoxypiperidin-4-yl)-(4-methylpiperidin-1-yl)methanone

C13H24N2O2 — CID 119675095

IUPAC(4-methoxypiperidin-4-yl)-(4-methylpiperidin-1-yl)methanone
SMILESCOC1(C(=O)N2CCC(C)CC2)CCNCC1
InChIInChI=1S/C13H24N2O2/c1-11-3-9-15(10-4-11)12(16)13(17-2)5-7-14-8-6-13/h11,14H,3-10H2,1-2H3
InChIKeyQQKGHZPYNQFPJB-UHFFFAOYSA-N
MW240.35 g/mol
LogP1.01
Rot. Bonds2

About (4-methoxypiperidin-4-yl)-(4-methylpiperidin-1-yl)methanone

(4-methoxypiperidin-4-yl)-(4-methylpiperidin-1-yl)methanone (PubChem CID 119675095) has the molecular formula C13H24N2O2 and a molecular weight of 240.35 g/mol. Its IUPAC name is (4-methoxypiperidin-4-yl)-(4-methylpiperidin-1-yl)methanone.

Molecular Properties

Compound Name(4-methoxypiperidin-4-yl)-(4-methylpiperidin-1-yl)methanone
PubChem CID119675095
Molecular FormulaC13H24N2O2
Molecular Weight240.35 g/mol
Exact Mass240.18
IUPAC Name(4-methoxypiperidin-4-yl)-(4-methylpiperidin-1-yl)methanone
SMILESCOC1(C(=O)N2CCC(C)CC2)CCNCC1
InChIInChI=1S/C13H24N2O2/c1-11-3-9-15(10-4-11)12(16)13(17-2)5-7-14-8-6-13/h11,14H,3-10H2,1-2H3
InChIKeyQQKGHZPYNQFPJB-UHFFFAOYSA-N
XLogP1.01
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.35
LogP ≤ 51.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(4-methoxypiperidin-4-yl)-[4-(4-methylcyclohexyl)oxypiperidin-1-yl]methanone
CID 119779842
[4-[(dimethylamino)methyl]piperidin-1-yl]-(4-methoxypiperidin-4-yl)methanone
CID 119852056
azepan-1-yl-(4-methoxypiperidin-4-yl)methanone
CID 84702052
(1-methoxycyclopropyl)-(3-methylpyrrolidin-1-yl)methanone
CID 169181474
1,4-diazepan-1-yl-(4-methoxypiperidin-4-yl)methanone
CID 113265250
2-[4-(4-methoxypiperidine-4-carbonyl)piperazin-1-yl]-N-(4-methylcyclohexyl)acetamide
CID 119876665
(4,4-dimethylazepan-1-yl)-(4-methoxypiperidin-4-yl)methanone;hydrochloride
CID 119803723
(4-methoxypiperidin-4-yl)-(4-propoxyazepan-1-yl)methanone
CID 119780028
(4-methoxypiperidin-4-yl)-(2-methylthiomorpholin-4-yl)methanone
CID 119774206
(4-methoxypiperidin-4-yl)-[3-(piperidin-1-ylmethyl)pyrrolidin-1-yl]methanone
CID 119894734
2-[4-(4-methoxypiperidine-4-carbonyl)piperazin-1-yl]-1-(2-methylpiperidin-1-yl)ethanone
CID 119851426
[3-(diethylaminomethyl)pyrrolidin-1-yl]-(4-methoxypiperidin-4-yl)methanone;dihydrochloride
CID 119894888

Frequently Asked Questions

What is the IUPAC name of (4-methoxypiperidin-4-yl)-(4-methylpiperidin-1-yl)methanone?
The IUPAC name of (4-methoxypiperidin-4-yl)-(4-methylpiperidin-1-yl)methanone (CID 119675095) is (4-methoxypiperidin-4-yl)-(4-methylpiperidin-1-yl)methanone.
What is the SMILES notation for (4-methoxypiperidin-4-yl)-(4-methylpiperidin-1-yl)methanone?
The canonical SMILES for (4-methoxypiperidin-4-yl)-(4-methylpiperidin-1-yl)methanone is COC1(C(=O)N2CCC(C)CC2)CCNCC1.
What is the InChIKey of (4-methoxypiperidin-4-yl)-(4-methylpiperidin-1-yl)methanone?
The InChIKey is QQKGHZPYNQFPJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O2/c1-11-3-9-15(10-4-11)12(16)13(17-2)5-7-14-8-6-13/h11,14H,3-10H2,1-2H3.
What are the key properties of (4-methoxypiperidin-4-yl)-(4-methylpiperidin-1-yl)methanone?
(4-methoxypiperidin-4-yl)-(4-methylpiperidin-1-yl)methanone has a molecular weight of 240.35 g/mol, XLogP of 1.01, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4-methoxypiperidin-4-yl)-(4-methylpiperidin-1-yl)methanone is sourced from PubChem (CID 119675095), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).