N-(4-fluorophenyl)pent-4-ynamide

C11H10FNO — CID 72544109

IUPACN-(4-fluorophenyl)pent-4-ynamide
SMILESC#CCCC(=O)Nc1ccc([18F])cc1
InChIInChI=1S/C11H10FNO/c1-2-3-4-11(14)13-10-7-5-9(12)6-8-10/h1,5-8H,3-4H2,(H,13,14)/i12-1
InChIKeyWPNJUHMNHCMSMH-DWSYCVKZSA-N
MW190.21 g/mol
LogP2.18
Rot. Bonds3

About N-(4-fluorophenyl)pent-4-ynamide

N-(4-fluorophenyl)pent-4-ynamide (PubChem CID 72544109) has the molecular formula C11H10FNO and a molecular weight of 190.21 g/mol. Its IUPAC name is N-(4-fluorophenyl)pent-4-ynamide.

Molecular Properties

Compound NameN-(4-fluorophenyl)pent-4-ynamide
PubChem CID72544109
Molecular FormulaC11H10FNO
Molecular Weight190.21 g/mol
Exact Mass190.08
IUPAC NameN-(4-fluorophenyl)pent-4-ynamide
SMILESC#CCCC(=O)Nc1ccc([18F])cc1
InChIInChI=1S/C11H10FNO/c1-2-3-4-11(14)13-10-7-5-9(12)6-8-10/h1,5-8H,3-4H2,(H,13,14)/i12-1
InChIKeyWPNJUHMNHCMSMH-DWSYCVKZSA-N
XLogP2.18
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.21
LogP ≤ 52.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'triple_bond', 'substructure': 'N/A'}

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Related Compounds

N-(4-methylphenyl)pent-4-ynamide
CID 82363120
N-(4-fluorophenyl)-3-hydroxypropanamide
CID 12748696
N-(4-fluorophenyl)-2-(prop-2-ynylamino)acetamide
CID 28563124
N'-(4-fluorophenyl)hept-6-ynehydrazide
CID 126805755
7-(4-fluoroanilino)-7-oxoheptanoic acid
CID 68559650
2-chloro-N-(4-fluorophenyl)acetamide
CID 532065
3-(ethylamino)-N-(4-fluorophenyl)propanamide
CID 62832288
N'-(4-fluorophenyl)propanediamide
CID 18174009
(3R)-N,N'-bis(4-fluorophenyl)-3-methylhexanediamide
CID 7432118
N,N'-bis(4-fluorophenyl)-3-methylhexanediamide
CID 2832938
N'-(2,4-difluorophenyl)-N-(4-fluorophenyl)butanediamide
CID 670678
N-[4-[4-[(2-hydroxyacetyl)amino]benzoyl]phenyl]hex-5-ynamide
CID 87370028

Frequently Asked Questions

What is the IUPAC name of N-(4-fluorophenyl)pent-4-ynamide?
The IUPAC name of N-(4-fluorophenyl)pent-4-ynamide (CID 72544109) is N-(4-fluorophenyl)pent-4-ynamide.
What is the SMILES notation for N-(4-fluorophenyl)pent-4-ynamide?
The canonical SMILES for N-(4-fluorophenyl)pent-4-ynamide is C#CCCC(=O)Nc1ccc([18F])cc1.
What is the InChIKey of N-(4-fluorophenyl)pent-4-ynamide?
The InChIKey is WPNJUHMNHCMSMH-DWSYCVKZSA-N. The full InChI is InChI=1S/C11H10FNO/c1-2-3-4-11(14)13-10-7-5-9(12)6-8-10/h1,5-8H,3-4H2,(H,13,14)/i12-1.
What are the key properties of N-(4-fluorophenyl)pent-4-ynamide?
N-(4-fluorophenyl)pent-4-ynamide has a molecular weight of 190.21 g/mol, XLogP of 2.18, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-fluorophenyl)pent-4-ynamide is sourced from PubChem (CID 72544109), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).