1-(2-naphthalen-2-yloxyacetyl)piperidine-4-carboxamide

C18H20N2O3 — CID 1117184

IUPAC1-(2-naphthalen-2-yloxyacetyl)piperidine-4-carboxamide
SMILESNC(=O)C1CCN(C(=O)COc2ccc3ccccc3c2)CC1
InChIInChI=1S/C18H20N2O3/c19-18(22)14-7-9-20(10-8-14)17(21)12-23-16-6-5-13-3-1-2-4-15(13)11-16/h1-6,11,14H,7-10,12H2,(H2,19,22)
InChIKeyCLEGHVZJUIGOCJ-UHFFFAOYSA-N
MW312.37 g/mol
LogP1.94
Rot. Bonds4

About 1-(2-naphthalen-2-yloxyacetyl)piperidine-4-carboxamide

1-(2-naphthalen-2-yloxyacetyl)piperidine-4-carboxamide (PubChem CID 1117184) has the molecular formula C18H20N2O3 and a molecular weight of 312.37 g/mol. Its IUPAC name is 1-(2-naphthalen-2-yloxyacetyl)piperidine-4-carboxamide.

Molecular Properties

Compound Name1-(2-naphthalen-2-yloxyacetyl)piperidine-4-carboxamide
PubChem CID1117184
Molecular FormulaC18H20N2O3
Molecular Weight312.37 g/mol
Exact Mass312.15
IUPAC Name1-(2-naphthalen-2-yloxyacetyl)piperidine-4-carboxamide
SMILESNC(=O)C1CCN(C(=O)COc2ccc3ccccc3c2)CC1
InChIInChI=1S/C18H20N2O3/c19-18(22)14-7-9-20(10-8-14)17(21)12-23-16-6-5-13-3-1-2-4-15(13)11-16/h1-6,11,14H,7-10,12H2,(H2,19,22)
InChIKeyCLEGHVZJUIGOCJ-UHFFFAOYSA-N
XLogP1.94
TPSA72.63 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.37
LogP ≤ 51.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(2-naphthalen-2-yloxyacetyl)piperidine-4-carboxamide?
The IUPAC name of 1-(2-naphthalen-2-yloxyacetyl)piperidine-4-carboxamide (CID 1117184) is 1-(2-naphthalen-2-yloxyacetyl)piperidine-4-carboxamide.
What is the SMILES notation for 1-(2-naphthalen-2-yloxyacetyl)piperidine-4-carboxamide?
The canonical SMILES for 1-(2-naphthalen-2-yloxyacetyl)piperidine-4-carboxamide is NC(=O)C1CCN(C(=O)COc2ccc3ccccc3c2)CC1.
What is the InChIKey of 1-(2-naphthalen-2-yloxyacetyl)piperidine-4-carboxamide?
The InChIKey is CLEGHVZJUIGOCJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N2O3/c19-18(22)14-7-9-20(10-8-14)17(21)12-23-16-6-5-13-3-1-2-4-15(13)11-16/h1-6,11,14H,7-10,12H2,(H2,19,22).
What are the key properties of 1-(2-naphthalen-2-yloxyacetyl)piperidine-4-carboxamide?
1-(2-naphthalen-2-yloxyacetyl)piperidine-4-carboxamide has a molecular weight of 312.37 g/mol, XLogP of 1.94, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-naphthalen-2-yloxyacetyl)piperidine-4-carboxamide is sourced from PubChem (CID 1117184), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).