2-(3-methoxyphenoxy)-N-[2-(piperidine-1-carbonyl)phenyl]butanamide

C23H28N2O4 — CID 46764443

IUPAC2-(3-methoxyphenoxy)-N-[2-(piperidine-1-carbonyl)phenyl]butanamide
SMILESCCC(Oc1cccc(OC)c1)C(=O)Nc1ccccc1C(=O)N1CCCCC1
InChIInChI=1S/C23H28N2O4/c1-3-21(29-18-11-9-10-17(16-18)28-2)22(26)24-20-13-6-5-12-19(20)23(27)25-14-7-4-8-15-25/h5-6,9-13,16,21H,3-4,7-8,14-15H2,1-2H3,(H,24,26)
InChIKeyLSULWOHGSYVZSX-UHFFFAOYSA-N
MW396.49 g/mol
LogP4.12
Rot. Bonds7

About 2-(3-methoxyphenoxy)-N-[2-(piperidine-1-carbonyl)phenyl]butanamide

2-(3-methoxyphenoxy)-N-[2-(piperidine-1-carbonyl)phenyl]butanamide (PubChem CID 46764443) has the molecular formula C23H28N2O4 and a molecular weight of 396.49 g/mol. Its IUPAC name is 2-(3-methoxyphenoxy)-N-[2-(piperidine-1-carbonyl)phenyl]butanamide.

Molecular Properties

Compound Name2-(3-methoxyphenoxy)-N-[2-(piperidine-1-carbonyl)phenyl]butanamide
PubChem CID46764443
Molecular FormulaC23H28N2O4
Molecular Weight396.49 g/mol
Exact Mass396.20
IUPAC Name2-(3-methoxyphenoxy)-N-[2-(piperidine-1-carbonyl)phenyl]butanamide
SMILESCCC(Oc1cccc(OC)c1)C(=O)Nc1ccccc1C(=O)N1CCCCC1
InChIInChI=1S/C23H28N2O4/c1-3-21(29-18-11-9-10-17(16-18)28-2)22(26)24-20-13-6-5-12-19(20)23(27)25-14-7-4-8-15-25/h5-6,9-13,16,21H,3-4,7-8,14-15H2,1-2H3,(H,24,26)
InChIKeyLSULWOHGSYVZSX-UHFFFAOYSA-N
XLogP4.12
TPSA67.87 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500396.49
LogP ≤ 54.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(2S)-N-[2-(azepane-1-carbonyl)phenyl]-2-(3-methoxyphenoxy)butanamide
CID 28632970
2-(3-methoxyphenoxy)-N-[2-(morpholine-4-carbonyl)phenyl]butanamide
CID 53284266
(2R)-2-(3-methoxyphenoxy)-N-[2-(morpholine-4-carbonyl)phenyl]butanamide
CID 92672077
2-(3-methylphenoxy)-N-[2-(piperidine-1-carbonyl)phenyl]butanamide
CID 4928588
(2S)-N-[2-(azepane-1-carbonyl)phenyl]-2-(3-methylphenoxy)butanamide
CID 92947905
(2R)-2-(3-methoxyphenoxy)-N-[2-(piperidine-1-carbonyl)phenyl]propanamide
CID 28637146
(2R)-2-naphthalen-2-yloxy-N-[2-(pyrrolidine-1-carbonyl)phenyl]butanamide
CID 28633196
(2S)-2-naphthalen-2-yloxy-N-[2-(pyrrolidine-1-carbonyl)phenyl]butanamide
CID 28633197
(2R)-2-naphthalen-1-yloxy-N-[2-(piperidine-1-carbonyl)phenyl]butanamide
CID 92682982
(2R)-2-(4-methoxyphenoxy)-N-[2-(morpholine-4-carbonyl)phenyl]butanamide
CID 26074932
(2R)-2-(2,3-dimethylphenoxy)-N-[2-(piperidine-1-carbonyl)phenyl]butanamide
CID 38004411
(2R)-N-[2-(azepane-1-carbonyl)phenyl]-2-(2-fluorophenoxy)butanamide
CID 40747464

Frequently Asked Questions

What is the IUPAC name of 2-(3-methoxyphenoxy)-N-[2-(piperidine-1-carbonyl)phenyl]butanamide?
The IUPAC name of 2-(3-methoxyphenoxy)-N-[2-(piperidine-1-carbonyl)phenyl]butanamide (CID 46764443) is 2-(3-methoxyphenoxy)-N-[2-(piperidine-1-carbonyl)phenyl]butanamide.
What is the SMILES notation for 2-(3-methoxyphenoxy)-N-[2-(piperidine-1-carbonyl)phenyl]butanamide?
The canonical SMILES for 2-(3-methoxyphenoxy)-N-[2-(piperidine-1-carbonyl)phenyl]butanamide is CCC(Oc1cccc(OC)c1)C(=O)Nc1ccccc1C(=O)N1CCCCC1.
What is the InChIKey of 2-(3-methoxyphenoxy)-N-[2-(piperidine-1-carbonyl)phenyl]butanamide?
The InChIKey is LSULWOHGSYVZSX-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H28N2O4/c1-3-21(29-18-11-9-10-17(16-18)28-2)22(26)24-20-13-6-5-12-19(20)23(27)25-14-7-4-8-15-25/h5-6,9-13,16,21H,3-4,7-8,14-15H2,1-2H3,(H,24,26).
What are the key properties of 2-(3-methoxyphenoxy)-N-[2-(piperidine-1-carbonyl)phenyl]butanamide?
2-(3-methoxyphenoxy)-N-[2-(piperidine-1-carbonyl)phenyl]butanamide has a molecular weight of 396.49 g/mol, XLogP of 4.12, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-methoxyphenoxy)-N-[2-(piperidine-1-carbonyl)phenyl]butanamide is sourced from PubChem (CID 46764443), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).