N-(2-cyanophenyl)-2-[4-(2-fluorophenyl)piperazin-1-yl]acetamide

C19H19FN4O — CID 670932

IUPACN-(2-cyanophenyl)-2-[4-(2-fluorophenyl)piperazin-1-yl]acetamide
SMILESN#Cc1ccccc1NC(=O)CN1CCN(c2ccccc2F)CC1
InChIInChI=1S/C19H19FN4O/c20-16-6-2-4-8-18(16)24-11-9-23(10-12-24)14-19(25)22-17-7-3-1-5-15(17)13-21/h1-8H,9-12,14H2,(H,22,25)
InChIKeyVIYDXLYTDDIBIK-UHFFFAOYSA-N
MW338.39 g/mol
LogP2.46
Rot. Bonds4

About N-(2-cyanophenyl)-2-[4-(2-fluorophenyl)piperazin-1-yl]acetamide

N-(2-cyanophenyl)-2-[4-(2-fluorophenyl)piperazin-1-yl]acetamide (PubChem CID 670932) has the molecular formula C19H19FN4O and a molecular weight of 338.39 g/mol. Its IUPAC name is N-(2-cyanophenyl)-2-[4-(2-fluorophenyl)piperazin-1-yl]acetamide.

Molecular Properties

Compound NameN-(2-cyanophenyl)-2-[4-(2-fluorophenyl)piperazin-1-yl]acetamide
PubChem CID670932
Molecular FormulaC19H19FN4O
Molecular Weight338.39 g/mol
Exact Mass338.15
IUPAC NameN-(2-cyanophenyl)-2-[4-(2-fluorophenyl)piperazin-1-yl]acetamide
SMILESN#Cc1ccccc1NC(=O)CN1CCN(c2ccccc2F)CC1
InChIInChI=1S/C19H19FN4O/c20-16-6-2-4-8-18(16)24-11-9-23(10-12-24)14-19(25)22-17-7-3-1-5-15(17)13-21/h1-8H,9-12,14H2,(H,22,25)
InChIKeyVIYDXLYTDDIBIK-UHFFFAOYSA-N
XLogP2.46
TPSA59.37 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.39
LogP ≤ 52.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-cyanophenyl)-2-[4-(4-fluorophenyl)piperazin-1-yl]acetamide
CID 671206
N'-(2-cyanophenyl)-N-[2-[4-(2-fluorophenyl)piperazin-1-yl]ethyl]oxamide
CID 42269158
2-[4-(2-fluorophenyl)piperazin-1-yl]-N-naphthalen-1-ylacetamide
CID 1439401
N-(2,6-difluorophenyl)-2-[4-(2-fluorophenyl)piperazin-1-yl]acetamide
CID 27150835
N-(2,5-dichlorophenyl)-2-[4-(2-fluorophenyl)piperazin-1-yl]acetamide
CID 2120382
2-[4-(2-fluorophenyl)piperazin-1-yl]acetohydrazide
CID 63570220
2-[4-(2-cyanophenyl)sulfonylpiperazin-1-yl]-N-(2-fluorophenyl)acetamide
CID 9286817
2-(4-benzhydrylpiperazin-1-yl)-N-(2-cyanophenyl)acetamide
CID 2653850
N-(4-acetylphenyl)-2-[4-(2-fluorophenyl)piperazin-1-yl]acetamide;hydrochloride
CID 171668840
N-(2-cyanophenyl)-N'-(2-fluorophenyl)propanediamide
CID 108954791
1-[2-(2-cyanoanilino)-2-oxoethyl]piperidine-4-carboxamide
CID 799678
N-(2-cyanophenyl)-2-(3-hydroxyazetidin-1-yl)acetamide
CID 63281967

Frequently Asked Questions

What is the IUPAC name of N-(2-cyanophenyl)-2-[4-(2-fluorophenyl)piperazin-1-yl]acetamide?
The IUPAC name of N-(2-cyanophenyl)-2-[4-(2-fluorophenyl)piperazin-1-yl]acetamide (CID 670932) is N-(2-cyanophenyl)-2-[4-(2-fluorophenyl)piperazin-1-yl]acetamide.
What is the SMILES notation for N-(2-cyanophenyl)-2-[4-(2-fluorophenyl)piperazin-1-yl]acetamide?
The canonical SMILES for N-(2-cyanophenyl)-2-[4-(2-fluorophenyl)piperazin-1-yl]acetamide is N#Cc1ccccc1NC(=O)CN1CCN(c2ccccc2F)CC1.
What is the InChIKey of N-(2-cyanophenyl)-2-[4-(2-fluorophenyl)piperazin-1-yl]acetamide?
The InChIKey is VIYDXLYTDDIBIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19FN4O/c20-16-6-2-4-8-18(16)24-11-9-23(10-12-24)14-19(25)22-17-7-3-1-5-15(17)13-21/h1-8H,9-12,14H2,(H,22,25).
What are the key properties of N-(2-cyanophenyl)-2-[4-(2-fluorophenyl)piperazin-1-yl]acetamide?
N-(2-cyanophenyl)-2-[4-(2-fluorophenyl)piperazin-1-yl]acetamide has a molecular weight of 338.39 g/mol, XLogP of 2.46, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyanophenyl)-2-[4-(2-fluorophenyl)piperazin-1-yl]acetamide is sourced from PubChem (CID 670932), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).