N-[2-(dimethylamino)-3-phenylpropyl]-2-(2-oxo-1-pyridinyl)acetamide

C18H23N3O2 — CID 51175658

IUPACN-[2-(dimethylamino)-3-phenylpropyl]-2-(2-oxo-1-pyridinyl)acetamide
SMILESCN(C)C(CNC(=O)Cn1ccccc1=O)Cc1ccccc1
InChIInChI=1S/C18H23N3O2/c1-20(2)16(12-15-8-4-3-5-9-15)13-19-17(22)14-21-11-7-6-10-18(21)23/h3-11,16H,12-14H2,1-2H3,(H,19,22)
InChIKeyRDYFYRXBYBGILJ-UHFFFAOYSA-N
MW313.40 g/mol
LogP1.14
Rot. Bonds7

About N-[2-(dimethylamino)-3-phenylpropyl]-2-(2-oxo-1-pyridinyl)acetamide

N-[2-(dimethylamino)-3-phenylpropyl]-2-(2-oxo-1-pyridinyl)acetamide (PubChem CID 51175658) has the molecular formula C18H23N3O2 and a molecular weight of 313.40 g/mol. Its IUPAC name is N-[2-(dimethylamino)-3-phenylpropyl]-2-(2-oxo-1-pyridinyl)acetamide.

Molecular Properties

Compound NameN-[2-(dimethylamino)-3-phenylpropyl]-2-(2-oxo-1-pyridinyl)acetamide
PubChem CID51175658
Molecular FormulaC18H23N3O2
Molecular Weight313.40 g/mol
Exact Mass313.18
IUPAC NameN-[2-(dimethylamino)-3-phenylpropyl]-2-(2-oxo-1-pyridinyl)acetamide
SMILESCN(C)C(CNC(=O)Cn1ccccc1=O)Cc1ccccc1
InChIInChI=1S/C18H23N3O2/c1-20(2)16(12-15-8-4-3-5-9-15)13-19-17(22)14-21-11-7-6-10-18(21)23/h3-11,16H,12-14H2,1-2H3,(H,19,22)
InChIKeyRDYFYRXBYBGILJ-UHFFFAOYSA-N
XLogP1.14
TPSA54.34 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms23
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.40
LogP ≤ 51.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[2-(dimethylamino)-3-phenylpropyl]-2-(2-oxo-1-pyridinyl)acetamide?
The IUPAC name of N-[2-(dimethylamino)-3-phenylpropyl]-2-(2-oxo-1-pyridinyl)acetamide (CID 51175658) is N-[2-(dimethylamino)-3-phenylpropyl]-2-(2-oxo-1-pyridinyl)acetamide.
What is the SMILES notation for N-[2-(dimethylamino)-3-phenylpropyl]-2-(2-oxo-1-pyridinyl)acetamide?
The canonical SMILES for N-[2-(dimethylamino)-3-phenylpropyl]-2-(2-oxo-1-pyridinyl)acetamide is CN(C)C(CNC(=O)Cn1ccccc1=O)Cc1ccccc1.
What is the InChIKey of N-[2-(dimethylamino)-3-phenylpropyl]-2-(2-oxo-1-pyridinyl)acetamide?
The InChIKey is RDYFYRXBYBGILJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23N3O2/c1-20(2)16(12-15-8-4-3-5-9-15)13-19-17(22)14-21-11-7-6-10-18(21)23/h3-11,16H,12-14H2,1-2H3,(H,19,22).
What are the key properties of N-[2-(dimethylamino)-3-phenylpropyl]-2-(2-oxo-1-pyridinyl)acetamide?
N-[2-(dimethylamino)-3-phenylpropyl]-2-(2-oxo-1-pyridinyl)acetamide has a molecular weight of 313.40 g/mol, XLogP of 1.14, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(dimethylamino)-3-phenylpropyl]-2-(2-oxo-1-pyridinyl)acetamide is sourced from PubChem (CID 51175658), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).