N-[(3-methoxyphenyl)methyl]-2-piperidin-3-ylacetamide

C15H22N2O2 — CID 62691062

IUPACN-[(3-methoxyphenyl)methyl]-2-piperidin-3-ylacetamide
SMILESCOc1cccc(CNC(=O)CC2CCCNC2)c1
InChIInChI=1S/C15H22N2O2/c1-19-14-6-2-4-12(8-14)11-17-15(18)9-13-5-3-7-16-10-13/h2,4,6,8,13,16H,3,5,7,9-11H2,1H3,(H,17,18)
InChIKeyHOOKLYYWLWUOLQ-UHFFFAOYSA-N
MW262.35 g/mol
LogP1.70
Rot. Bonds5

About N-[(3-methoxyphenyl)methyl]-2-piperidin-3-ylacetamide

N-[(3-methoxyphenyl)methyl]-2-piperidin-3-ylacetamide (PubChem CID 62691062) has the molecular formula C15H22N2O2 and a molecular weight of 262.35 g/mol. Its IUPAC name is N-[(3-methoxyphenyl)methyl]-2-piperidin-3-ylacetamide.

Molecular Properties

Compound NameN-[(3-methoxyphenyl)methyl]-2-piperidin-3-ylacetamide
PubChem CID62691062
Molecular FormulaC15H22N2O2
Molecular Weight262.35 g/mol
Exact Mass262.17
IUPAC NameN-[(3-methoxyphenyl)methyl]-2-piperidin-3-ylacetamide
SMILESCOc1cccc(CNC(=O)CC2CCCNC2)c1
InChIInChI=1S/C15H22N2O2/c1-19-14-6-2-4-12(8-14)11-17-15(18)9-13-5-3-7-16-10-13/h2,4,6,8,13,16H,3,5,7,9-11H2,1H3,(H,17,18)
InChIKeyHOOKLYYWLWUOLQ-UHFFFAOYSA-N
XLogP1.70
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.35
LogP ≤ 51.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(3-methoxyphenyl)methyl]-2-piperidin-4-ylacetamide
CID 61028976
N-[(3-fluorophenyl)methyl]-2-piperidin-3-ylacetamide
CID 55105179
N-[(3-cyanophenyl)methyl]-2-piperidin-3-ylacetamide
CID 62676322
N-[(3-methoxyphenyl)methyl]-2-methyl-2-piperidin-3-ylpropanamide
CID 83034070
2-piperidin-3-yl-N-(pyridin-3-ylmethyl)acetamide
CID 62675411
2-(cyclopropylmethylamino)-N-[(3-methoxyphenyl)methyl]acetamide;hydrochloride
CID 119678219
2-[(3-methoxyphenyl)methoxy]-N-(piperidin-3-ylmethyl)propanamide;hydrochloride
CID 119462030
N-[(3-hydroxyphenyl)methyl]-2-[(3S)-pyrrolidin-3-yl]acetamide
CID 58032857
N-[[3-(hydroxymethyl)phenyl]methyl]-2-pyrrolidin-3-ylacetamide
CID 104954757
(2S)-N-[(3-methoxyphenyl)methyl]pyrrolidine-2-carboxamide
CID 50944119
2-(3-methoxyphenyl)-N-(2-pyrrolidin-3-ylethyl)acetamide
CID 55248998
1-cyclobutyl-N-[(3-methoxyphenyl)methyl]methanamine
CID 43298537

Frequently Asked Questions

What is the IUPAC name of N-[(3-methoxyphenyl)methyl]-2-piperidin-3-ylacetamide?
The IUPAC name of N-[(3-methoxyphenyl)methyl]-2-piperidin-3-ylacetamide (CID 62691062) is N-[(3-methoxyphenyl)methyl]-2-piperidin-3-ylacetamide.
What is the SMILES notation for N-[(3-methoxyphenyl)methyl]-2-piperidin-3-ylacetamide?
The canonical SMILES for N-[(3-methoxyphenyl)methyl]-2-piperidin-3-ylacetamide is COc1cccc(CNC(=O)CC2CCCNC2)c1.
What is the InChIKey of N-[(3-methoxyphenyl)methyl]-2-piperidin-3-ylacetamide?
The InChIKey is HOOKLYYWLWUOLQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O2/c1-19-14-6-2-4-12(8-14)11-17-15(18)9-13-5-3-7-16-10-13/h2,4,6,8,13,16H,3,5,7,9-11H2,1H3,(H,17,18).
What are the key properties of N-[(3-methoxyphenyl)methyl]-2-piperidin-3-ylacetamide?
N-[(3-methoxyphenyl)methyl]-2-piperidin-3-ylacetamide has a molecular weight of 262.35 g/mol, XLogP of 1.70, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3-methoxyphenyl)methyl]-2-piperidin-3-ylacetamide is sourced from PubChem (CID 62691062), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).