[2-(2-aminoethyl)piperidin-1-yl]-(2-methoxyphenyl)methanone

C15H22N2O2 — CID 63755191

IUPAC[2-(2-aminoethyl)piperidin-1-yl]-(2-methoxyphenyl)methanone
SMILESCOc1ccccc1C(=O)N1CCCCC1CCN
InChIInChI=1S/C15H22N2O2/c1-19-14-8-3-2-7-13(14)15(18)17-11-5-4-6-12(17)9-10-16/h2-3,7-8,12H,4-6,9-11,16H2,1H3
InChIKeyFYTNOWNQYASYCG-UHFFFAOYSA-N
MW262.35 g/mol
LogP2.04
Rot. Bonds4

About [2-(2-aminoethyl)piperidin-1-yl]-(2-methoxyphenyl)methanone

[2-(2-aminoethyl)piperidin-1-yl]-(2-methoxyphenyl)methanone (PubChem CID 63755191) has the molecular formula C15H22N2O2 and a molecular weight of 262.35 g/mol. Its IUPAC name is [2-(2-aminoethyl)piperidin-1-yl]-(2-methoxyphenyl)methanone.

Molecular Properties

Compound Name[2-(2-aminoethyl)piperidin-1-yl]-(2-methoxyphenyl)methanone
PubChem CID63755191
Molecular FormulaC15H22N2O2
Molecular Weight262.35 g/mol
Exact Mass262.17
IUPAC Name[2-(2-aminoethyl)piperidin-1-yl]-(2-methoxyphenyl)methanone
SMILESCOc1ccccc1C(=O)N1CCCCC1CCN
InChIInChI=1S/C15H22N2O2/c1-19-14-8-3-2-7-13(14)15(18)17-11-5-4-6-12(17)9-10-16/h2-3,7-8,12H,4-6,9-11,16H2,1H3
InChIKeyFYTNOWNQYASYCG-UHFFFAOYSA-N
XLogP2.04
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.35
LogP ≤ 52.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[(2S)-2-(aminomethyl)pyrrolidin-1-yl]-(2-methoxyphenyl)methanone
CID 28706937
(2-methoxyphenyl)-[2-(sulfanylmethyl)pyrrolidin-1-yl]methanone
CID 20623537
(2-methoxyphenyl)-[(2R)-2-(sulfanylmethyl)pyrrolidin-1-yl]methanone
CID 59949488
[2-(2-aminoethyl)piperidin-1-yl]-(3-chloro-2-methylphenyl)methanone
CID 107098180
[2-(aminomethyl)piperidin-1-yl]-(2,3-dimethoxyphenyl)methanone;hydrochloride
CID 119469424
[2-(2-aminoethyl)piperidin-1-yl]-(2,3-dihydroxyphenyl)methanone
CID 114345040
[2-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)azepan-1-yl]-(2-methoxyphenyl)methanone
CID 91909231
[2-(2-bromoethyl)piperidin-1-yl]-(2-ethoxyphenyl)methanone
CID 80665458
[2-(aminomethyl)pyrrolidin-1-yl]-(2-hydroxy-3-methoxyphenyl)methanone
CID 63754345
[2-(2-bromoethyl)piperidin-1-yl]-(4-chloro-2-methoxyphenyl)methanone
CID 80666287
[2-(chloromethyl)piperidin-1-yl]-(2-hydroxy-3-methoxyphenyl)methanone
CID 63395526
[2-(2-aminoethyl)piperidin-1-yl]-(3-bromo-2-fluorophenyl)methanone
CID 107956136

Frequently Asked Questions

What is the IUPAC name of [2-(2-aminoethyl)piperidin-1-yl]-(2-methoxyphenyl)methanone?
The IUPAC name of [2-(2-aminoethyl)piperidin-1-yl]-(2-methoxyphenyl)methanone (CID 63755191) is [2-(2-aminoethyl)piperidin-1-yl]-(2-methoxyphenyl)methanone.
What is the SMILES notation for [2-(2-aminoethyl)piperidin-1-yl]-(2-methoxyphenyl)methanone?
The canonical SMILES for [2-(2-aminoethyl)piperidin-1-yl]-(2-methoxyphenyl)methanone is COc1ccccc1C(=O)N1CCCCC1CCN.
What is the InChIKey of [2-(2-aminoethyl)piperidin-1-yl]-(2-methoxyphenyl)methanone?
The InChIKey is FYTNOWNQYASYCG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O2/c1-19-14-8-3-2-7-13(14)15(18)17-11-5-4-6-12(17)9-10-16/h2-3,7-8,12H,4-6,9-11,16H2,1H3.
What are the key properties of [2-(2-aminoethyl)piperidin-1-yl]-(2-methoxyphenyl)methanone?
[2-(2-aminoethyl)piperidin-1-yl]-(2-methoxyphenyl)methanone has a molecular weight of 262.35 g/mol, XLogP of 2.04, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(2-aminoethyl)piperidin-1-yl]-(2-methoxyphenyl)methanone is sourced from PubChem (CID 63755191), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).