N-[1-[2-(4-ethoxyphenoxy)acetyl]piperidin-4-yl]naphthalene-1-carboxamide

C26H28N2O4 — CID 108554067

IUPACN-[1-[2-(4-ethoxyphenoxy)acetyl]piperidin-4-yl]naphthalene-1-carboxamide
SMILESCCOc1ccc(OCC(=O)N2CCC(NC(=O)c3cccc4ccccc34)CC2)cc1
InChIInChI=1S/C26H28N2O4/c1-2-31-21-10-12-22(13-11-21)32-18-25(29)28-16-14-20(15-17-28)27-26(30)24-9-5-7-19-6-3-4-8-23(19)24/h3-13,20H,2,14-18H2,1H3,(H,27,30)
InChIKeyWVSCPXREFFAVPL-UHFFFAOYSA-N
MW432.52 g/mol
LogP4.04
Rot. Bonds7

About N-[1-[2-(4-ethoxyphenoxy)acetyl]piperidin-4-yl]naphthalene-1-carboxamide

N-[1-[2-(4-ethoxyphenoxy)acetyl]piperidin-4-yl]naphthalene-1-carboxamide (PubChem CID 108554067) has the molecular formula C26H28N2O4 and a molecular weight of 432.52 g/mol. Its IUPAC name is N-[1-[2-(4-ethoxyphenoxy)acetyl]piperidin-4-yl]naphthalene-1-carboxamide.

Molecular Properties

Compound NameN-[1-[2-(4-ethoxyphenoxy)acetyl]piperidin-4-yl]naphthalene-1-carboxamide
PubChem CID108554067
Molecular FormulaC26H28N2O4
Molecular Weight432.52 g/mol
Exact Mass432.20
IUPAC NameN-[1-[2-(4-ethoxyphenoxy)acetyl]piperidin-4-yl]naphthalene-1-carboxamide
SMILESCCOc1ccc(OCC(=O)N2CCC(NC(=O)c3cccc4ccccc34)CC2)cc1
InChIInChI=1S/C26H28N2O4/c1-2-31-21-10-12-22(13-11-21)32-18-25(29)28-16-14-20(15-17-28)27-26(30)24-9-5-7-19-6-3-4-8-23(19)24/h3-13,20H,2,14-18H2,1H3,(H,27,30)
InChIKeyWVSCPXREFFAVPL-UHFFFAOYSA-N
XLogP4.04
TPSA67.87 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500432.52
LogP ≤ 54.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[1-[2-(4-chlorophenoxy)acetyl]piperidin-4-yl]naphthalene-1-carboxamide
CID 108554046
N-[1-[2-(2,3,6-trimethylphenoxy)acetyl]piperidin-4-yl]naphthalene-1-carboxamide
CID 108554034
2-(4-ethoxyphenoxy)-N-[1-(2-phenoxyacetyl)piperidin-4-yl]acetamide
CID 108556308
N-[1-[2-(4-ethoxyphenoxy)acetyl]piperidin-4-yl]-2-phenylacetamide
CID 108551305
methyl 4-(naphthalene-1-carbonylamino)piperidine-1-carboxylate
CID 108561371
4-ethoxy-N-[1-[2-(4-methylphenoxy)acetyl]piperidin-4-yl]benzamide
CID 108551924
N-[1-(naphthalene-1-carbonyl)piperidin-4-yl]naphthalene-1-carboxamide
CID 108554043
(E)-N-[1-[2-(4-ethoxyphenoxy)acetyl]piperidin-4-yl]-3-phenylprop-2-enamide
CID 108566451
N-[1-[2-(3,4-dimethylphenoxy)acetyl]piperidin-4-yl]-4-ethoxybenzamide
CID 108551882
N-[1-[2-(4-ethoxyphenoxy)acetyl]piperidin-4-yl]-2-(4-methylphenoxy)acetamide
CID 108557001
N-[1-[2-(4-ethoxyphenoxy)acetyl]piperidin-4-yl]-2,2,2-trifluoroacetamide
CID 108548748
N-[1-(3-phenylpropanoyl)piperidin-4-yl]naphthalene-1-carboxamide
CID 108554058

Frequently Asked Questions

What is the IUPAC name of N-[1-[2-(4-ethoxyphenoxy)acetyl]piperidin-4-yl]naphthalene-1-carboxamide?
The IUPAC name of N-[1-[2-(4-ethoxyphenoxy)acetyl]piperidin-4-yl]naphthalene-1-carboxamide (CID 108554067) is N-[1-[2-(4-ethoxyphenoxy)acetyl]piperidin-4-yl]naphthalene-1-carboxamide.
What is the SMILES notation for N-[1-[2-(4-ethoxyphenoxy)acetyl]piperidin-4-yl]naphthalene-1-carboxamide?
The canonical SMILES for N-[1-[2-(4-ethoxyphenoxy)acetyl]piperidin-4-yl]naphthalene-1-carboxamide is CCOc1ccc(OCC(=O)N2CCC(NC(=O)c3cccc4ccccc34)CC2)cc1.
What is the InChIKey of N-[1-[2-(4-ethoxyphenoxy)acetyl]piperidin-4-yl]naphthalene-1-carboxamide?
The InChIKey is WVSCPXREFFAVPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H28N2O4/c1-2-31-21-10-12-22(13-11-21)32-18-25(29)28-16-14-20(15-17-28)27-26(30)24-9-5-7-19-6-3-4-8-23(19)24/h3-13,20H,2,14-18H2,1H3,(H,27,30).
What are the key properties of N-[1-[2-(4-ethoxyphenoxy)acetyl]piperidin-4-yl]naphthalene-1-carboxamide?
N-[1-[2-(4-ethoxyphenoxy)acetyl]piperidin-4-yl]naphthalene-1-carboxamide has a molecular weight of 432.52 g/mol, XLogP of 4.04, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-[2-(4-ethoxyphenoxy)acetyl]piperidin-4-yl]naphthalene-1-carboxamide is sourced from PubChem (CID 108554067), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).