N,N-dimethyl-2-[2-(4-phenylpiperidine-1-carbonyl)phenoxy]acetamide

C22H26N2O3 — CID 39580956

IUPACN,N-dimethyl-2-[2-(4-phenylpiperidine-1-carbonyl)phenoxy]acetamide
SMILESCN(C)C(=O)COc1ccccc1C(=O)N1CCC(c2ccccc2)CC1
InChIInChI=1S/C22H26N2O3/c1-23(2)21(25)16-27-20-11-7-6-10-19(20)22(26)24-14-12-18(13-15-24)17-8-4-3-5-9-17/h3-11,18H,12-16H2,1-2H3
InChIKeyDZIBWPHBTLULTQ-UHFFFAOYSA-N
MW366.46 g/mol
LogP3.17
Rot. Bonds5

About N,N-dimethyl-2-[2-(4-phenylpiperidine-1-carbonyl)phenoxy]acetamide

N,N-dimethyl-2-[2-(4-phenylpiperidine-1-carbonyl)phenoxy]acetamide (PubChem CID 39580956) has the molecular formula C22H26N2O3 and a molecular weight of 366.46 g/mol. Its IUPAC name is N,N-dimethyl-2-[2-(4-phenylpiperidine-1-carbonyl)phenoxy]acetamide.

Molecular Properties

Compound NameN,N-dimethyl-2-[2-(4-phenylpiperidine-1-carbonyl)phenoxy]acetamide
PubChem CID39580956
Molecular FormulaC22H26N2O3
Molecular Weight366.46 g/mol
Exact Mass366.19
IUPAC NameN,N-dimethyl-2-[2-(4-phenylpiperidine-1-carbonyl)phenoxy]acetamide
SMILESCN(C)C(=O)COc1ccccc1C(=O)N1CCC(c2ccccc2)CC1
InChIInChI=1S/C22H26N2O3/c1-23(2)21(25)16-27-20-11-7-6-10-19(20)22(26)24-14-12-18(13-15-24)17-8-4-3-5-9-17/h3-11,18H,12-16H2,1-2H3
InChIKeyDZIBWPHBTLULTQ-UHFFFAOYSA-N
XLogP3.17
TPSA49.85 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.46
LogP ≤ 53.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-2-[2-(4-phenylpiperidine-1-carbonyl)phenoxy]acetamide?
The IUPAC name of N,N-dimethyl-2-[2-(4-phenylpiperidine-1-carbonyl)phenoxy]acetamide (CID 39580956) is N,N-dimethyl-2-[2-(4-phenylpiperidine-1-carbonyl)phenoxy]acetamide.
What is the SMILES notation for N,N-dimethyl-2-[2-(4-phenylpiperidine-1-carbonyl)phenoxy]acetamide?
The canonical SMILES for N,N-dimethyl-2-[2-(4-phenylpiperidine-1-carbonyl)phenoxy]acetamide is CN(C)C(=O)COc1ccccc1C(=O)N1CCC(c2ccccc2)CC1.
What is the InChIKey of N,N-dimethyl-2-[2-(4-phenylpiperidine-1-carbonyl)phenoxy]acetamide?
The InChIKey is DZIBWPHBTLULTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H26N2O3/c1-23(2)21(25)16-27-20-11-7-6-10-19(20)22(26)24-14-12-18(13-15-24)17-8-4-3-5-9-17/h3-11,18H,12-16H2,1-2H3.
What are the key properties of N,N-dimethyl-2-[2-(4-phenylpiperidine-1-carbonyl)phenoxy]acetamide?
N,N-dimethyl-2-[2-(4-phenylpiperidine-1-carbonyl)phenoxy]acetamide has a molecular weight of 366.46 g/mol, XLogP of 3.17, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-2-[2-(4-phenylpiperidine-1-carbonyl)phenoxy]acetamide is sourced from PubChem (CID 39580956), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).