N-[2-(dimethylamino)phenyl]-2-(1-phenylpyrazol-4-yl)acetamide

C19H20N4O — CID 39130549

IUPACN-[2-(dimethylamino)phenyl]-2-(1-phenylpyrazol-4-yl)acetamide
SMILESCN(C)c1ccccc1NC(=O)Cc1cnn(-c2ccccc2)c1
InChIInChI=1S/C19H20N4O/c1-22(2)18-11-7-6-10-17(18)21-19(24)12-15-13-20-23(14-15)16-8-4-3-5-9-16/h3-11,13-14H,12H2,1-2H3,(H,21,24)
InChIKeyPABHDKXOCZNDSP-UHFFFAOYSA-N
MW320.40 g/mol
LogP3.12
Rot. Bonds5

About N-[2-(dimethylamino)phenyl]-2-(1-phenylpyrazol-4-yl)acetamide

N-[2-(dimethylamino)phenyl]-2-(1-phenylpyrazol-4-yl)acetamide (PubChem CID 39130549) has the molecular formula C19H20N4O and a molecular weight of 320.40 g/mol. Its IUPAC name is N-[2-(dimethylamino)phenyl]-2-(1-phenylpyrazol-4-yl)acetamide.

Molecular Properties

Compound NameN-[2-(dimethylamino)phenyl]-2-(1-phenylpyrazol-4-yl)acetamide
PubChem CID39130549
Molecular FormulaC19H20N4O
Molecular Weight320.40 g/mol
Exact Mass320.16
IUPAC NameN-[2-(dimethylamino)phenyl]-2-(1-phenylpyrazol-4-yl)acetamide
SMILESCN(C)c1ccccc1NC(=O)Cc1cnn(-c2ccccc2)c1
InChIInChI=1S/C19H20N4O/c1-22(2)18-11-7-6-10-17(18)21-19(24)12-15-13-20-23(14-15)16-8-4-3-5-9-16/h3-11,13-14H,12H2,1-2H3,(H,21,24)
InChIKeyPABHDKXOCZNDSP-UHFFFAOYSA-N
XLogP3.12
TPSA50.16 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.40
LogP ≤ 53.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[2-(dimethylamino)phenyl]-2-(1-phenylpyrazol-4-yl)acetamide?
The IUPAC name of N-[2-(dimethylamino)phenyl]-2-(1-phenylpyrazol-4-yl)acetamide (CID 39130549) is N-[2-(dimethylamino)phenyl]-2-(1-phenylpyrazol-4-yl)acetamide.
What is the SMILES notation for N-[2-(dimethylamino)phenyl]-2-(1-phenylpyrazol-4-yl)acetamide?
The canonical SMILES for N-[2-(dimethylamino)phenyl]-2-(1-phenylpyrazol-4-yl)acetamide is CN(C)c1ccccc1NC(=O)Cc1cnn(-c2ccccc2)c1.
What is the InChIKey of N-[2-(dimethylamino)phenyl]-2-(1-phenylpyrazol-4-yl)acetamide?
The InChIKey is PABHDKXOCZNDSP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N4O/c1-22(2)18-11-7-6-10-17(18)21-19(24)12-15-13-20-23(14-15)16-8-4-3-5-9-16/h3-11,13-14H,12H2,1-2H3,(H,21,24).
What are the key properties of N-[2-(dimethylamino)phenyl]-2-(1-phenylpyrazol-4-yl)acetamide?
N-[2-(dimethylamino)phenyl]-2-(1-phenylpyrazol-4-yl)acetamide has a molecular weight of 320.40 g/mol, XLogP of 3.12, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(dimethylamino)phenyl]-2-(1-phenylpyrazol-4-yl)acetamide is sourced from PubChem (CID 39130549), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).