[3-(4-methoxypiperidin-1-yl)azetidin-1-yl]-naphthalen-1-ylmethanone

C20H24N2O2 — CID 122243216

IUPAC[3-(4-methoxypiperidin-1-yl)azetidin-1-yl]-naphthalen-1-ylmethanone
SMILESCOC1CCN(C2CN(C(=O)c3cccc4ccccc34)C2)CC1
InChIInChI=1S/C20H24N2O2/c1-24-17-9-11-21(12-10-17)16-13-22(14-16)20(23)19-8-4-6-15-5-2-3-7-18(15)19/h2-8,16-17H,9-14H2,1H3
InChIKeyAWVXSXHSBUAUOM-UHFFFAOYSA-N
MW324.42 g/mol
LogP2.78
Rot. Bonds3

About [3-(4-methoxypiperidin-1-yl)azetidin-1-yl]-naphthalen-1-ylmethanone

[3-(4-methoxypiperidin-1-yl)azetidin-1-yl]-naphthalen-1-ylmethanone (PubChem CID 122243216) has the molecular formula C20H24N2O2 and a molecular weight of 324.42 g/mol. Its IUPAC name is [3-(4-methoxypiperidin-1-yl)azetidin-1-yl]-naphthalen-1-ylmethanone.

Molecular Properties

Compound Name[3-(4-methoxypiperidin-1-yl)azetidin-1-yl]-naphthalen-1-ylmethanone
PubChem CID122243216
Molecular FormulaC20H24N2O2
Molecular Weight324.42 g/mol
Exact Mass324.18
IUPAC Name[3-(4-methoxypiperidin-1-yl)azetidin-1-yl]-naphthalen-1-ylmethanone
SMILESCOC1CCN(C2CN(C(=O)c3cccc4ccccc34)C2)CC1
InChIInChI=1S/C20H24N2O2/c1-24-17-9-11-21(12-10-17)16-13-22(14-16)20(23)19-8-4-6-15-5-2-3-7-18(15)19/h2-8,16-17H,9-14H2,1H3
InChIKeyAWVXSXHSBUAUOM-UHFFFAOYSA-N
XLogP2.78
TPSA32.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.42
LogP ≤ 52.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

(2-bromophenyl)-[4-(4-methoxypiperidin-1-yl)piperidin-1-yl]methanone
CID 90616521
(3-methylpiperidin-1-yl)-naphthalen-1-ylmethanone
CID 4284306
2-(4-methoxypiperidine-1-carbonyl)benzoic acid
CID 43372663
naphthalen-1-yl-[4-(4-phenylcyclohexyl)piperazin-1-yl]methanone
CID 1360777
naphthalen-1-yl-[(3R)-3-pyridin-4-yloxypyrrolidin-1-yl]methanone
CID 124878377
1-[3-(4-methoxypiperidin-1-yl)azetidin-1-yl]propan-1-one
CID 169229049
(8-bromonaphthalen-1-yl)-(4-methoxypiperidin-1-yl)methanone
CID 171661899
[4-(ethylaminomethyl)piperidin-1-yl]-naphthalen-1-ylmethanone
CID 119645989
[4-[4-(2-methoxyphenyl)piperazin-1-yl]piperidin-1-yl]-naphthalen-1-ylmethanone;oxalic acid
CID 17369253
N-(3-methoxyphenyl)-1-[1-(naphthalene-1-carbonyl)piperidin-4-yl]piperidine-4-carboxamide
CID 42881516
methyl 2-[[1-(naphthalene-1-carbonyl)piperidine-4-carbonyl]amino]benzoate
CID 55430267
[(1S,5S)-6-(cyclopropylmethyl)-3,6-diazabicyclo[3.2.2]nonan-3-yl]-naphthalen-1-ylmethanone
CID 133109725

Frequently Asked Questions

What is the IUPAC name of [3-(4-methoxypiperidin-1-yl)azetidin-1-yl]-naphthalen-1-ylmethanone?
The IUPAC name of [3-(4-methoxypiperidin-1-yl)azetidin-1-yl]-naphthalen-1-ylmethanone (CID 122243216) is [3-(4-methoxypiperidin-1-yl)azetidin-1-yl]-naphthalen-1-ylmethanone.
What is the SMILES notation for [3-(4-methoxypiperidin-1-yl)azetidin-1-yl]-naphthalen-1-ylmethanone?
The canonical SMILES for [3-(4-methoxypiperidin-1-yl)azetidin-1-yl]-naphthalen-1-ylmethanone is COC1CCN(C2CN(C(=O)c3cccc4ccccc34)C2)CC1.
What is the InChIKey of [3-(4-methoxypiperidin-1-yl)azetidin-1-yl]-naphthalen-1-ylmethanone?
The InChIKey is AWVXSXHSBUAUOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N2O2/c1-24-17-9-11-21(12-10-17)16-13-22(14-16)20(23)19-8-4-6-15-5-2-3-7-18(15)19/h2-8,16-17H,9-14H2,1H3.
What are the key properties of [3-(4-methoxypiperidin-1-yl)azetidin-1-yl]-naphthalen-1-ylmethanone?
[3-(4-methoxypiperidin-1-yl)azetidin-1-yl]-naphthalen-1-ylmethanone has a molecular weight of 324.42 g/mol, XLogP of 2.78, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(4-methoxypiperidin-1-yl)azetidin-1-yl]-naphthalen-1-ylmethanone is sourced from PubChem (CID 122243216), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).