(3-methoxy-8-azabicyclo[3.2.1]octan-8-yl)-(1-methylpiperidin-4-yl)methanone

C15H26N2O2 — CID 122255361

IUPAC(3-methoxy-8-azabicyclo[3.2.1]octan-8-yl)-(1-methylpiperidin-4-yl)methanone
SMILESCOC1CC2CCC(C1)N2C(=O)C1CCN(C)CC1
InChIInChI=1S/C15H26N2O2/c1-16-7-5-11(6-8-16)15(18)17-12-3-4-13(17)10-14(9-12)19-2/h11-14H,3-10H2,1-2H3
InChIKeyPAPNZXRZUDWNPW-UHFFFAOYSA-N
MW266.38 g/mol
LogP1.50
Rot. Bonds2

About (3-methoxy-8-azabicyclo[3.2.1]octan-8-yl)-(1-methylpiperidin-4-yl)methanone

(3-methoxy-8-azabicyclo[3.2.1]octan-8-yl)-(1-methylpiperidin-4-yl)methanone (PubChem CID 122255361) has the molecular formula C15H26N2O2 and a molecular weight of 266.38 g/mol. Its IUPAC name is (3-methoxy-8-azabicyclo[3.2.1]octan-8-yl)-(1-methylpiperidin-4-yl)methanone.

Molecular Properties

Compound Name(3-methoxy-8-azabicyclo[3.2.1]octan-8-yl)-(1-methylpiperidin-4-yl)methanone
PubChem CID122255361
Molecular FormulaC15H26N2O2
Molecular Weight266.38 g/mol
Exact Mass266.20
IUPAC Name(3-methoxy-8-azabicyclo[3.2.1]octan-8-yl)-(1-methylpiperidin-4-yl)methanone
SMILESCOC1CC2CCC(C1)N2C(=O)C1CCN(C)CC1
InChIInChI=1S/C15H26N2O2/c1-16-7-5-11(6-8-16)15(18)17-12-3-4-13(17)10-14(9-12)19-2/h11-14H,3-10H2,1-2H3
InChIKeyPAPNZXRZUDWNPW-UHFFFAOYSA-N
XLogP1.50
TPSA32.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.38
LogP ≤ 51.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

(3-methoxy-8-azabicyclo[3.2.1]octan-8-yl)-(oxan-4-yl)methanone
CID 122269046
(1-methylpiperidin-4-yl)-(3-methylsulfanyl-8-azabicyclo[3.2.1]octan-8-yl)methanone
CID 90615980
(3-methoxy-8-azabicyclo[3.2.1]octan-8-yl)-(4-methylpiperazin-1-yl)methanone
CID 122269132
1-(3-methoxy-8-azabicyclo[3.2.1]octane-8-carbonyl)imidazolidin-2-one
CID 122255495
1-(3,4-dimethylphenyl)-4-(3-methoxy-8-azabicyclo[3.2.1]octane-8-carbonyl)pyrrolidin-2-one
CID 122255272
[4-(dimethylamino)piperidin-1-yl]-(3-methoxycyclobutyl)methanone
CID 154866121
1-[4-(3-pyridin-3-yloxy-8-azabicyclo[3.2.1]octane-8-carbonyl)piperidin-1-yl]ethanone
CID 121186032
2,3-dihydro-1,4-benzodioxin-3-yl-(3-methoxy-8-azabicyclo[3.2.1]octan-8-yl)methanone
CID 122255234
(4-methoxypiperidin-1-yl)-[1-(4-methylcyclohexyl)piperidin-4-yl]methanone
CID 171833705
cycloheptyl-(1-methylpiperidin-4-yl)methanone
CID 144802313
[2-(aminomethyl)-4-methoxypiperidin-1-yl]-(1-methylpyrrolidin-3-yl)methanone
CID 112622258
methyl 1-(1-methylpiperidin-4-yl)piperidine-4-carboxylate
CID 145006373

Frequently Asked Questions

What is the IUPAC name of (3-methoxy-8-azabicyclo[3.2.1]octan-8-yl)-(1-methylpiperidin-4-yl)methanone?
The IUPAC name of (3-methoxy-8-azabicyclo[3.2.1]octan-8-yl)-(1-methylpiperidin-4-yl)methanone (CID 122255361) is (3-methoxy-8-azabicyclo[3.2.1]octan-8-yl)-(1-methylpiperidin-4-yl)methanone.
What is the SMILES notation for (3-methoxy-8-azabicyclo[3.2.1]octan-8-yl)-(1-methylpiperidin-4-yl)methanone?
The canonical SMILES for (3-methoxy-8-azabicyclo[3.2.1]octan-8-yl)-(1-methylpiperidin-4-yl)methanone is COC1CC2CCC(C1)N2C(=O)C1CCN(C)CC1.
What is the InChIKey of (3-methoxy-8-azabicyclo[3.2.1]octan-8-yl)-(1-methylpiperidin-4-yl)methanone?
The InChIKey is PAPNZXRZUDWNPW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2O2/c1-16-7-5-11(6-8-16)15(18)17-12-3-4-13(17)10-14(9-12)19-2/h11-14H,3-10H2,1-2H3.
What are the key properties of (3-methoxy-8-azabicyclo[3.2.1]octan-8-yl)-(1-methylpiperidin-4-yl)methanone?
(3-methoxy-8-azabicyclo[3.2.1]octan-8-yl)-(1-methylpiperidin-4-yl)methanone has a molecular weight of 266.38 g/mol, XLogP of 1.50, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3-methoxy-8-azabicyclo[3.2.1]octan-8-yl)-(1-methylpiperidin-4-yl)methanone is sourced from PubChem (CID 122255361), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).