N-[(2-methoxyphenyl)methyl]-2-[(3S)-3-methylpiperidin-1-yl]acetamide

C16H24N2O2 — CID 8903458

IUPACN-[(2-methoxyphenyl)methyl]-2-[(3S)-3-methylpiperidin-1-yl]acetamide
SMILESCOc1ccccc1CNC(=O)CN1CCC[C@H](C)C1
InChIInChI=1S/C16H24N2O2/c1-13-6-5-9-18(11-13)12-16(19)17-10-14-7-3-4-8-15(14)20-2/h3-4,7-8,13H,5-6,9-12H2,1-2H3,(H,17,19)/t13-/m0/s1
InChIKeyGHPKCROLRBCUIE-ZDUSSCGKSA-N
MW276.38 g/mol
LogP2.04
Rot. Bonds5

About N-[(2-methoxyphenyl)methyl]-2-[(3S)-3-methylpiperidin-1-yl]acetamide

N-[(2-methoxyphenyl)methyl]-2-[(3S)-3-methylpiperidin-1-yl]acetamide (PubChem CID 8903458) has the molecular formula C16H24N2O2 and a molecular weight of 276.38 g/mol. Its IUPAC name is N-[(2-methoxyphenyl)methyl]-2-[(3S)-3-methylpiperidin-1-yl]acetamide.

Molecular Properties

Compound NameN-[(2-methoxyphenyl)methyl]-2-[(3S)-3-methylpiperidin-1-yl]acetamide
PubChem CID8903458
Molecular FormulaC16H24N2O2
Molecular Weight276.38 g/mol
Exact Mass276.18
IUPAC NameN-[(2-methoxyphenyl)methyl]-2-[(3S)-3-methylpiperidin-1-yl]acetamide
SMILESCOc1ccccc1CNC(=O)CN1CCC[C@H](C)C1
InChIInChI=1S/C16H24N2O2/c1-13-6-5-9-18(11-13)12-16(19)17-10-14-7-3-4-8-15(14)20-2/h3-4,7-8,13H,5-6,9-12H2,1-2H3,(H,17,19)/t13-/m0/s1
InChIKeyGHPKCROLRBCUIE-ZDUSSCGKSA-N
XLogP2.04
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 52.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(2-methoxyphenyl)methyl]-2-[3-(methylamino)piperidin-1-yl]acetamide;hydrochloride
CID 119920219
N-[(2-methoxyphenyl)methyl]-2-pyrrolidin-1-ylacetamide
CID 8901770
N-[(2-methylphenyl)methyl]-2-(3-methylpiperidin-1-yl)acetamide
CID 108996675
2-(azocan-1-yl)-N-[(2-methoxyphenyl)methyl]acetamide
CID 51170947
2-[(3R)-3-hydroxypyrrolidin-1-yl]-N-[(2-methoxyphenyl)methyl]acetamide
CID 78963608
2-(1,3,3a,4,5,6,7,7a-octahydroisoindol-2-yl)-N-[(2-methoxyphenyl)methyl]acetamide
CID 171704523
N-[(2-methoxyphenyl)methyl]-2-[3-(methylamino)pyrrolidin-1-yl]acetamide;hydrochloride
CID 119905867
2-(4-fluoropiperidin-1-yl)-N-[(2-methoxyphenyl)methyl]acetamide
CID 171701323
N-[(2-methoxyphenyl)methyl]-4-[(3-methylpiperidin-1-yl)methyl]benzamide
CID 53283594
N-[(3,4-dimethoxyphenyl)methyl]-2-(3-methylpiperidin-1-yl)acetamide
CID 18083473
N-[(2-methoxyphenyl)methyl]-2-[3-(pyridine-2-carbonyl)piperidin-1-yl]acetamide
CID 91829279
2-(3,9-diazabicyclo[4.2.1]nonan-3-yl)-N-[(2-methoxyphenyl)methyl]acetamide;hydrochloride
CID 119927680

Frequently Asked Questions

What is the IUPAC name of N-[(2-methoxyphenyl)methyl]-2-[(3S)-3-methylpiperidin-1-yl]acetamide?
The IUPAC name of N-[(2-methoxyphenyl)methyl]-2-[(3S)-3-methylpiperidin-1-yl]acetamide (CID 8903458) is N-[(2-methoxyphenyl)methyl]-2-[(3S)-3-methylpiperidin-1-yl]acetamide.
What is the SMILES notation for N-[(2-methoxyphenyl)methyl]-2-[(3S)-3-methylpiperidin-1-yl]acetamide?
The canonical SMILES for N-[(2-methoxyphenyl)methyl]-2-[(3S)-3-methylpiperidin-1-yl]acetamide is COc1ccccc1CNC(=O)CN1CCC[C@H](C)C1.
What is the InChIKey of N-[(2-methoxyphenyl)methyl]-2-[(3S)-3-methylpiperidin-1-yl]acetamide?
The InChIKey is GHPKCROLRBCUIE-ZDUSSCGKSA-N. The full InChI is InChI=1S/C16H24N2O2/c1-13-6-5-9-18(11-13)12-16(19)17-10-14-7-3-4-8-15(14)20-2/h3-4,7-8,13H,5-6,9-12H2,1-2H3,(H,17,19)/t13-/m0/s1.
What are the key properties of N-[(2-methoxyphenyl)methyl]-2-[(3S)-3-methylpiperidin-1-yl]acetamide?
N-[(2-methoxyphenyl)methyl]-2-[(3S)-3-methylpiperidin-1-yl]acetamide has a molecular weight of 276.38 g/mol, XLogP of 2.04, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-methoxyphenyl)methyl]-2-[(3S)-3-methylpiperidin-1-yl]acetamide is sourced from PubChem (CID 8903458), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).