N-(4-fluorophenyl)-2-(4-phenylpiperazin-1-yl)acetamide

C18H20FN3O — CID 600180

IUPACN-(4-fluorophenyl)-2-(4-phenylpiperazin-1-yl)acetamide
SMILESO=C(CN1CCN(c2ccccc2)CC1)Nc1ccc(F)cc1
InChIInChI=1S/C18H20FN3O/c19-15-6-8-16(9-7-15)20-18(23)14-21-10-12-22(13-11-21)17-4-2-1-3-5-17/h1-9H,10-14H2,(H,20,23)
InChIKeyDDKGUFSNWAOROB-UHFFFAOYSA-N
MW313.38 g/mol
LogP2.59
Rot. Bonds4

About N-(4-fluorophenyl)-2-(4-phenylpiperazin-1-yl)acetamide

N-(4-fluorophenyl)-2-(4-phenylpiperazin-1-yl)acetamide (PubChem CID 600180) has the molecular formula C18H20FN3O and a molecular weight of 313.38 g/mol. Its IUPAC name is N-(4-fluorophenyl)-2-(4-phenylpiperazin-1-yl)acetamide.

Molecular Properties

Compound NameN-(4-fluorophenyl)-2-(4-phenylpiperazin-1-yl)acetamide
PubChem CID600180
Molecular FormulaC18H20FN3O
Molecular Weight313.38 g/mol
Exact Mass313.16
IUPAC NameN-(4-fluorophenyl)-2-(4-phenylpiperazin-1-yl)acetamide
SMILESO=C(CN1CCN(c2ccccc2)CC1)Nc1ccc(F)cc1
InChIInChI=1S/C18H20FN3O/c19-15-6-8-16(9-7-15)20-18(23)14-21-10-12-22(13-11-21)17-4-2-1-3-5-17/h1-9H,10-14H2,(H,20,23)
InChIKeyDDKGUFSNWAOROB-UHFFFAOYSA-N
XLogP2.59
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.38
LogP ≤ 52.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

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CID 8523
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CID 13966
N-(4-Piperidinyl)phenylacetamide
CID 74156
N-(3-fluorophenyl)-3-(4-methylpiperazin-1-yl)propanamide
CID 649412
N-Phenyl-1-piperidineacetamide
CID 78402
4-Morpholineacetamide, N-phenyl-
CID 201328
2-(benzylamino)-N-(4-fluorophenyl)acetamide
CID 670654
2-(4-phenylpiperazin-1-yl)-N-[3-(trifluoromethyl)phenyl]acetamide
CID 1278179
1-[4-(4-Aminophenyl)piperazin-1-yl]ethan-1-one
CID 736269
2(1H)-Quinoxalinone, 3,4-dihydro-
CID 185949

Frequently Asked Questions

What is the IUPAC name of N-(4-fluorophenyl)-2-(4-phenylpiperazin-1-yl)acetamide?
The IUPAC name of N-(4-fluorophenyl)-2-(4-phenylpiperazin-1-yl)acetamide (CID 600180) is N-(4-fluorophenyl)-2-(4-phenylpiperazin-1-yl)acetamide.
What is the SMILES notation for N-(4-fluorophenyl)-2-(4-phenylpiperazin-1-yl)acetamide?
The canonical SMILES for N-(4-fluorophenyl)-2-(4-phenylpiperazin-1-yl)acetamide is O=C(CN1CCN(c2ccccc2)CC1)Nc1ccc(F)cc1.
What is the InChIKey of N-(4-fluorophenyl)-2-(4-phenylpiperazin-1-yl)acetamide?
The InChIKey is DDKGUFSNWAOROB-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20FN3O/c19-15-6-8-16(9-7-15)20-18(23)14-21-10-12-22(13-11-21)17-4-2-1-3-5-17/h1-9H,10-14H2,(H,20,23).
What are the key properties of N-(4-fluorophenyl)-2-(4-phenylpiperazin-1-yl)acetamide?
N-(4-fluorophenyl)-2-(4-phenylpiperazin-1-yl)acetamide has a molecular weight of 313.38 g/mol, XLogP of 2.59, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-fluorophenyl)-2-(4-phenylpiperazin-1-yl)acetamide is sourced from PubChem (CID 600180), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).