2-naphthalen-1-yl-N-[2-oxo-2-[(5-piperidin-1-yl-2-pyridinyl)amino]ethyl]acetamide

C24H26N4O2 — CID 78878188

IUPAC2-naphthalen-1-yl-N-[2-oxo-2-[(5-piperidin-1-yl-2-pyridinyl)amino]ethyl]acetamide
SMILESO=C(Cc1cccc2ccccc12)NCC(=O)Nc1ccc(N2CCCCC2)cn1
InChIInChI=1S/C24H26N4O2/c29-23(15-19-9-6-8-18-7-2-3-10-21(18)19)26-17-24(30)27-22-12-11-20(16-25-22)28-13-4-1-5-14-28/h2-3,6-12,16H,1,4-5,13-15,17H2,(H,26,29)(H,25,27,30)
InChIKeyWSURRKSSUPVAAI-UHFFFAOYSA-N
MW402.50 g/mol
LogP3.52
Rot. Bonds6

About 2-naphthalen-1-yl-N-[2-oxo-2-[(5-piperidin-1-yl-2-pyridinyl)amino]ethyl]acetamide

2-naphthalen-1-yl-N-[2-oxo-2-[(5-piperidin-1-yl-2-pyridinyl)amino]ethyl]acetamide (PubChem CID 78878188) has the molecular formula C24H26N4O2 and a molecular weight of 402.50 g/mol. Its IUPAC name is 2-naphthalen-1-yl-N-[2-oxo-2-[(5-piperidin-1-yl-2-pyridinyl)amino]ethyl]acetamide.

Molecular Properties

Compound Name2-naphthalen-1-yl-N-[2-oxo-2-[(5-piperidin-1-yl-2-pyridinyl)amino]ethyl]acetamide
PubChem CID78878188
Molecular FormulaC24H26N4O2
Molecular Weight402.50 g/mol
Exact Mass402.21
IUPAC Name2-naphthalen-1-yl-N-[2-oxo-2-[(5-piperidin-1-yl-2-pyridinyl)amino]ethyl]acetamide
SMILESO=C(Cc1cccc2ccccc12)NCC(=O)Nc1ccc(N2CCCCC2)cn1
InChIInChI=1S/C24H26N4O2/c29-23(15-19-9-6-8-18-7-2-3-10-21(18)19)26-17-24(30)27-22-12-11-20(16-25-22)28-13-4-1-5-14-28/h2-3,6-12,16H,1,4-5,13-15,17H2,(H,26,29)(H,25,27,30)
InChIKeyWSURRKSSUPVAAI-UHFFFAOYSA-N
XLogP3.52
TPSA74.33 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms30
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500402.50
LogP ≤ 53.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-naphthalen-1-yl-N-[2-oxo-2-[(5-piperidin-1-yl-2-pyridinyl)amino]ethyl]acetamide?
The IUPAC name of 2-naphthalen-1-yl-N-[2-oxo-2-[(5-piperidin-1-yl-2-pyridinyl)amino]ethyl]acetamide (CID 78878188) is 2-naphthalen-1-yl-N-[2-oxo-2-[(5-piperidin-1-yl-2-pyridinyl)amino]ethyl]acetamide.
What is the SMILES notation for 2-naphthalen-1-yl-N-[2-oxo-2-[(5-piperidin-1-yl-2-pyridinyl)amino]ethyl]acetamide?
The canonical SMILES for 2-naphthalen-1-yl-N-[2-oxo-2-[(5-piperidin-1-yl-2-pyridinyl)amino]ethyl]acetamide is O=C(Cc1cccc2ccccc12)NCC(=O)Nc1ccc(N2CCCCC2)cn1.
What is the InChIKey of 2-naphthalen-1-yl-N-[2-oxo-2-[(5-piperidin-1-yl-2-pyridinyl)amino]ethyl]acetamide?
The InChIKey is WSURRKSSUPVAAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H26N4O2/c29-23(15-19-9-6-8-18-7-2-3-10-21(18)19)26-17-24(30)27-22-12-11-20(16-25-22)28-13-4-1-5-14-28/h2-3,6-12,16H,1,4-5,13-15,17H2,(H,26,29)(H,25,27,30).
What are the key properties of 2-naphthalen-1-yl-N-[2-oxo-2-[(5-piperidin-1-yl-2-pyridinyl)amino]ethyl]acetamide?
2-naphthalen-1-yl-N-[2-oxo-2-[(5-piperidin-1-yl-2-pyridinyl)amino]ethyl]acetamide has a molecular weight of 402.50 g/mol, XLogP of 3.52, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-naphthalen-1-yl-N-[2-oxo-2-[(5-piperidin-1-yl-2-pyridinyl)amino]ethyl]acetamide is sourced from PubChem (CID 78878188), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).