N-ethyl-2-[[2-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)acetyl]amino]acetamide

C17H23N3O2 — CID 8754275

IUPACN-ethyl-2-[[2-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)acetyl]amino]acetamide
SMILESCCNC(=O)CNC(=O)CN1CC=C(c2ccccc2)CC1
InChIInChI=1S/C17H23N3O2/c1-2-18-16(21)12-19-17(22)13-20-10-8-15(9-11-20)14-6-4-3-5-7-14/h3-8H,2,9-13H2,1H3,(H,18,21)(H,19,22)
InChIKeyODOZOOQRZBAJAG-UHFFFAOYSA-N
MW301.39 g/mol
LogP1.03
Rot. Bonds6

About N-ethyl-2-[[2-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)acetyl]amino]acetamide

N-ethyl-2-[[2-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)acetyl]amino]acetamide (PubChem CID 8754275) has the molecular formula C17H23N3O2 and a molecular weight of 301.39 g/mol. Its IUPAC name is N-ethyl-2-[[2-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)acetyl]amino]acetamide.

Molecular Properties

Compound NameN-ethyl-2-[[2-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)acetyl]amino]acetamide
PubChem CID8754275
Molecular FormulaC17H23N3O2
Molecular Weight301.39 g/mol
Exact Mass301.18
IUPAC NameN-ethyl-2-[[2-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)acetyl]amino]acetamide
SMILESCCNC(=O)CNC(=O)CN1CC=C(c2ccccc2)CC1
InChIInChI=1S/C17H23N3O2/c1-2-18-16(21)12-19-17(22)13-20-10-8-15(9-11-20)14-6-4-3-5-7-14/h3-8H,2,9-13H2,1H3,(H,18,21)(H,19,22)
InChIKeyODOZOOQRZBAJAG-UHFFFAOYSA-N
XLogP1.03
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.39
LogP ≤ 51.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-[[2-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)acetyl]amino]acetamide?
The IUPAC name of N-ethyl-2-[[2-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)acetyl]amino]acetamide (CID 8754275) is N-ethyl-2-[[2-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)acetyl]amino]acetamide.
What is the SMILES notation for N-ethyl-2-[[2-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)acetyl]amino]acetamide?
The canonical SMILES for N-ethyl-2-[[2-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)acetyl]amino]acetamide is CCNC(=O)CNC(=O)CN1CC=C(c2ccccc2)CC1.
What is the InChIKey of N-ethyl-2-[[2-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)acetyl]amino]acetamide?
The InChIKey is ODOZOOQRZBAJAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23N3O2/c1-2-18-16(21)12-19-17(22)13-20-10-8-15(9-11-20)14-6-4-3-5-7-14/h3-8H,2,9-13H2,1H3,(H,18,21)(H,19,22).
What are the key properties of N-ethyl-2-[[2-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)acetyl]amino]acetamide?
N-ethyl-2-[[2-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)acetyl]amino]acetamide has a molecular weight of 301.39 g/mol, XLogP of 1.03, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-[[2-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)acetyl]amino]acetamide is sourced from PubChem (CID 8754275), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).