2-(3-methylphenoxy)-N-(1-methylpiperidin-4-yl)acetamide

C15H22N2O2 — CID 47114454

IUPAC2-(3-methylphenoxy)-N-(1-methylpiperidin-4-yl)acetamide
SMILESCc1cccc(OCC(=O)NC2CCN(C)CC2)c1
InChIInChI=1S/C15H22N2O2/c1-12-4-3-5-14(10-12)19-11-15(18)16-13-6-8-17(2)9-7-13/h3-5,10,13H,6-9,11H2,1-2H3,(H,16,18)
InChIKeyNDRFHCKYIFXBQA-UHFFFAOYSA-N
MW262.35 g/mol
LogP1.58
Rot. Bonds4

About 2-(3-methylphenoxy)-N-(1-methylpiperidin-4-yl)acetamide

2-(3-methylphenoxy)-N-(1-methylpiperidin-4-yl)acetamide (PubChem CID 47114454) has the molecular formula C15H22N2O2 and a molecular weight of 262.35 g/mol. Its IUPAC name is 2-(3-methylphenoxy)-N-(1-methylpiperidin-4-yl)acetamide.

Molecular Properties

Compound Name2-(3-methylphenoxy)-N-(1-methylpiperidin-4-yl)acetamide
PubChem CID47114454
Molecular FormulaC15H22N2O2
Molecular Weight262.35 g/mol
Exact Mass262.17
IUPAC Name2-(3-methylphenoxy)-N-(1-methylpiperidin-4-yl)acetamide
SMILESCc1cccc(OCC(=O)NC2CCN(C)CC2)c1
InChIInChI=1S/C15H22N2O2/c1-12-4-3-5-14(10-12)19-11-15(18)16-13-6-8-17(2)9-7-13/h3-5,10,13H,6-9,11H2,1-2H3,(H,16,18)
InChIKeyNDRFHCKYIFXBQA-UHFFFAOYSA-N
XLogP1.58
TPSA41.57 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 ≤ 51.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-hydroxycyclohexyl)-2-(3-methylphenoxy)acetamide
CID 17453727
2-(3-methylphenoxy)-N-piperidin-4-ylacetamide;hydrochloride
CID 119388822
2-(3-methylphenoxy)-N-(1-pentanoylpiperidin-4-yl)acetamide
CID 110819560
ethyl 4-[[2-(3-ethoxyphenoxy)acetyl]amino]piperidine-1-carboxylate
CID 112977740
N-[1-[2-(3-methylphenoxy)acetyl]piperidin-4-yl]acetamide
CID 49348967
(2S)-2-(3-methylphenoxy)-N-(1-methylpiperidin-4-yl)butanamide
CID 95119203
N-[1-[2-(3-methylphenoxy)acetyl]piperidin-4-yl]pentanamide
CID 110822925
N-[(1S,2S,3R)-2,3-dimethylcyclohexyl]-2-(3-methylphenoxy)acetamide
CID 11920025
ethyl 4-[[2-(3-bromophenoxy)acetyl]amino]piperidine-1-carboxylate
CID 9012567
2-(3-methylphenoxy)-N-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)acetamide
CID 7286124
3-(3-aminophenoxy)-N-(1-methylpiperidin-4-yl)propanamide
CID 61094992
N-[1-[5-(4-methoxyphenyl)-1H-pyrazol-3-yl]piperidin-4-yl]-2-(3-methylphenoxy)acetamide
CID 91904760

Frequently Asked Questions

What is the IUPAC name of 2-(3-methylphenoxy)-N-(1-methylpiperidin-4-yl)acetamide?
The IUPAC name of 2-(3-methylphenoxy)-N-(1-methylpiperidin-4-yl)acetamide (CID 47114454) is 2-(3-methylphenoxy)-N-(1-methylpiperidin-4-yl)acetamide.
What is the SMILES notation for 2-(3-methylphenoxy)-N-(1-methylpiperidin-4-yl)acetamide?
The canonical SMILES for 2-(3-methylphenoxy)-N-(1-methylpiperidin-4-yl)acetamide is Cc1cccc(OCC(=O)NC2CCN(C)CC2)c1.
What is the InChIKey of 2-(3-methylphenoxy)-N-(1-methylpiperidin-4-yl)acetamide?
The InChIKey is NDRFHCKYIFXBQA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O2/c1-12-4-3-5-14(10-12)19-11-15(18)16-13-6-8-17(2)9-7-13/h3-5,10,13H,6-9,11H2,1-2H3,(H,16,18).
What are the key properties of 2-(3-methylphenoxy)-N-(1-methylpiperidin-4-yl)acetamide?
2-(3-methylphenoxy)-N-(1-methylpiperidin-4-yl)acetamide has a molecular weight of 262.35 g/mol, XLogP of 1.58, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-methylphenoxy)-N-(1-methylpiperidin-4-yl)acetamide is sourced from PubChem (CID 47114454), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).