N-[4-(2-oxopiperidin-1-yl)phenyl]naphthalene-1-carboxamide

C22H20N2O2 — CID 7687294

IUPACN-[4-(2-oxopiperidin-1-yl)phenyl]naphthalene-1-carboxamide
SMILESO=C(Nc1ccc(N2CCCCC2=O)cc1)c1cccc2ccccc12
InChIInChI=1S/C22H20N2O2/c25-21-10-3-4-15-24(21)18-13-11-17(12-14-18)23-22(26)20-9-5-7-16-6-1-2-8-19(16)20/h1-2,5-9,11-14H,3-4,10,15H2,(H,23,26)
InChIKeyOVCIZBIDOTYGCE-UHFFFAOYSA-N
MW344.41 g/mol
LogP4.61
Rot. Bonds3

About N-[4-(2-oxopiperidin-1-yl)phenyl]naphthalene-1-carboxamide

N-[4-(2-oxopiperidin-1-yl)phenyl]naphthalene-1-carboxamide (PubChem CID 7687294) has the molecular formula C22H20N2O2 and a molecular weight of 344.41 g/mol. Its IUPAC name is N-[4-(2-oxopiperidin-1-yl)phenyl]naphthalene-1-carboxamide.

Molecular Properties

Compound NameN-[4-(2-oxopiperidin-1-yl)phenyl]naphthalene-1-carboxamide
PubChem CID7687294
Molecular FormulaC22H20N2O2
Molecular Weight344.41 g/mol
Exact Mass344.15
IUPAC NameN-[4-(2-oxopiperidin-1-yl)phenyl]naphthalene-1-carboxamide
SMILESO=C(Nc1ccc(N2CCCCC2=O)cc1)c1cccc2ccccc12
InChIInChI=1S/C22H20N2O2/c25-21-10-3-4-15-24(21)18-13-11-17(12-14-18)23-22(26)20-9-5-7-16-6-1-2-8-19(16)20/h1-2,5-9,11-14H,3-4,10,15H2,(H,23,26)
InChIKeyOVCIZBIDOTYGCE-UHFFFAOYSA-N
XLogP4.61
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms26
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.41
LogP ≤ 54.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-[4-(2-oxopiperidin-1-yl)phenyl]naphthalene-1-carboxamide?
The IUPAC name of N-[4-(2-oxopiperidin-1-yl)phenyl]naphthalene-1-carboxamide (CID 7687294) is N-[4-(2-oxopiperidin-1-yl)phenyl]naphthalene-1-carboxamide.
What is the SMILES notation for N-[4-(2-oxopiperidin-1-yl)phenyl]naphthalene-1-carboxamide?
The canonical SMILES for N-[4-(2-oxopiperidin-1-yl)phenyl]naphthalene-1-carboxamide is O=C(Nc1ccc(N2CCCCC2=O)cc1)c1cccc2ccccc12.
What is the InChIKey of N-[4-(2-oxopiperidin-1-yl)phenyl]naphthalene-1-carboxamide?
The InChIKey is OVCIZBIDOTYGCE-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H20N2O2/c25-21-10-3-4-15-24(21)18-13-11-17(12-14-18)23-22(26)20-9-5-7-16-6-1-2-8-19(16)20/h1-2,5-9,11-14H,3-4,10,15H2,(H,23,26).
What are the key properties of N-[4-(2-oxopiperidin-1-yl)phenyl]naphthalene-1-carboxamide?
N-[4-(2-oxopiperidin-1-yl)phenyl]naphthalene-1-carboxamide has a molecular weight of 344.41 g/mol, XLogP of 4.61, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(2-oxopiperidin-1-yl)phenyl]naphthalene-1-carboxamide is sourced from PubChem (CID 7687294), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).