2-[3-[(3-methylphenyl)methoxy]phenyl]-N-(2-piperidin-3-ylethyl)acetamide

C23H30N2O2 — CID 119556601

IUPAC2-[3-[(3-methylphenyl)methoxy]phenyl]-N-(2-piperidin-3-ylethyl)acetamide
SMILESCc1cccc(COc2cccc(CC(=O)NCCC3CCCNC3)c2)c1
InChIInChI=1S/C23H30N2O2/c1-18-5-2-7-21(13-18)17-27-22-9-3-6-20(14-22)15-23(26)25-12-10-19-8-4-11-24-16-19/h2-3,5-7,9,13-14,19,24H,4,8,10-12,15-17H2,1H3,(H,25,26)
InChIKeyCGENCMRXDPTEBW-UHFFFAOYSA-N
MW366.51 g/mol
LogP3.62
Rot. Bonds8

About 2-[3-[(3-methylphenyl)methoxy]phenyl]-N-(2-piperidin-3-ylethyl)acetamide

2-[3-[(3-methylphenyl)methoxy]phenyl]-N-(2-piperidin-3-ylethyl)acetamide (PubChem CID 119556601) has the molecular formula C23H30N2O2 and a molecular weight of 366.51 g/mol. Its IUPAC name is 2-[3-[(3-methylphenyl)methoxy]phenyl]-N-(2-piperidin-3-ylethyl)acetamide.

Molecular Properties

Compound Name2-[3-[(3-methylphenyl)methoxy]phenyl]-N-(2-piperidin-3-ylethyl)acetamide
PubChem CID119556601
Molecular FormulaC23H30N2O2
Molecular Weight366.51 g/mol
Exact Mass366.23
IUPAC Name2-[3-[(3-methylphenyl)methoxy]phenyl]-N-(2-piperidin-3-ylethyl)acetamide
SMILESCc1cccc(COc2cccc(CC(=O)NCCC3CCCNC3)c2)c1
InChIInChI=1S/C23H30N2O2/c1-18-5-2-7-21(13-18)17-27-22-9-3-6-20(14-22)15-23(26)25-12-10-19-8-4-11-24-16-19/h2-3,5-7,9,13-14,19,24H,4,8,10-12,15-17H2,1H3,(H,25,26)
InChIKeyCGENCMRXDPTEBW-UHFFFAOYSA-N
XLogP3.62
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.51
LogP ≤ 53.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[3-[(3-chlorophenyl)methoxy]phenyl]-N-(2-pyrrolidin-3-ylethyl)acetamide
CID 119534430
2-(3-methoxyphenyl)-N-(2-pyrrolidin-3-ylethyl)acetamide
CID 55248998
2-(2,5-dimethylphenyl)-N-(2-piperidin-3-ylethyl)acetamide
CID 62538178
2-(4-methylphenyl)-N-(2-piperidin-3-ylethyl)acetamide;hydrochloride
CID 119260712
2-[3-[(3-methylphenyl)methoxy]phenyl]-N-(2-piperazin-1-ylethyl)acetamide;hydrochloride
CID 119446399
N-[2-(3-methylphenyl)ethyl]-2-piperidin-3-ylacetamide
CID 62690046
N-(2-piperidin-3-ylethyl)-2-[3-(trifluoromethyl)phenyl]acetamide;hydrochloride
CID 119558465
2-(3-bromophenoxy)-N-(2-piperidin-3-ylethyl)acetamide
CID 119557900
N-[3-[(3-methylphenyl)methoxy]phenyl]piperidine-3-carboxamide;hydrochloride
CID 119323699
N-[2-oxo-2-(2-piperidin-3-ylethylamino)ethyl]-2-phenylacetamide
CID 119555564
2-(2,5-dimethylphenoxy)-N-(2-piperidin-3-ylethyl)acetamide
CID 119557918
4-(3-methylphenoxy)-N-(piperidin-3-ylmethyl)butanamide
CID 119461960

Frequently Asked Questions

What is the IUPAC name of 2-[3-[(3-methylphenyl)methoxy]phenyl]-N-(2-piperidin-3-ylethyl)acetamide?
The IUPAC name of 2-[3-[(3-methylphenyl)methoxy]phenyl]-N-(2-piperidin-3-ylethyl)acetamide (CID 119556601) is 2-[3-[(3-methylphenyl)methoxy]phenyl]-N-(2-piperidin-3-ylethyl)acetamide.
What is the SMILES notation for 2-[3-[(3-methylphenyl)methoxy]phenyl]-N-(2-piperidin-3-ylethyl)acetamide?
The canonical SMILES for 2-[3-[(3-methylphenyl)methoxy]phenyl]-N-(2-piperidin-3-ylethyl)acetamide is Cc1cccc(COc2cccc(CC(=O)NCCC3CCCNC3)c2)c1.
What is the InChIKey of 2-[3-[(3-methylphenyl)methoxy]phenyl]-N-(2-piperidin-3-ylethyl)acetamide?
The InChIKey is CGENCMRXDPTEBW-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H30N2O2/c1-18-5-2-7-21(13-18)17-27-22-9-3-6-20(14-22)15-23(26)25-12-10-19-8-4-11-24-16-19/h2-3,5-7,9,13-14,19,24H,4,8,10-12,15-17H2,1H3,(H,25,26).
What are the key properties of 2-[3-[(3-methylphenyl)methoxy]phenyl]-N-(2-piperidin-3-ylethyl)acetamide?
2-[3-[(3-methylphenyl)methoxy]phenyl]-N-(2-piperidin-3-ylethyl)acetamide has a molecular weight of 366.51 g/mol, XLogP of 3.62, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-[(3-methylphenyl)methoxy]phenyl]-N-(2-piperidin-3-ylethyl)acetamide is sourced from PubChem (CID 119556601), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).