N-cyclopropyl-2-(4-fluorophenyl)-N-(pyridin-4-ylmethyl)acetamide

C17H17FN2O — CID 47011276

IUPACN-cyclopropyl-2-(4-fluorophenyl)-N-(pyridin-4-ylmethyl)acetamide
SMILESO=C(Cc1ccc(F)cc1)N(Cc1ccncc1)C1CC1
InChIInChI=1S/C17H17FN2O/c18-15-3-1-13(2-4-15)11-17(21)20(16-5-6-16)12-14-7-9-19-10-8-14/h1-4,7-10,16H,5-6,11-12H2
InChIKeyGNUCEQXCTASSID-UHFFFAOYSA-N
MW284.33 g/mol
LogP2.95
Rot. Bonds5

About N-cyclopropyl-2-(4-fluorophenyl)-N-(pyridin-4-ylmethyl)acetamide

N-cyclopropyl-2-(4-fluorophenyl)-N-(pyridin-4-ylmethyl)acetamide (PubChem CID 47011276) has the molecular formula C17H17FN2O and a molecular weight of 284.33 g/mol. Its IUPAC name is N-cyclopropyl-2-(4-fluorophenyl)-N-(pyridin-4-ylmethyl)acetamide.

Molecular Properties

Compound NameN-cyclopropyl-2-(4-fluorophenyl)-N-(pyridin-4-ylmethyl)acetamide
PubChem CID47011276
Molecular FormulaC17H17FN2O
Molecular Weight284.33 g/mol
Exact Mass284.13
IUPAC NameN-cyclopropyl-2-(4-fluorophenyl)-N-(pyridin-4-ylmethyl)acetamide
SMILESO=C(Cc1ccc(F)cc1)N(Cc1ccncc1)C1CC1
InChIInChI=1S/C17H17FN2O/c18-15-3-1-13(2-4-15)11-17(21)20(16-5-6-16)12-14-7-9-19-10-8-14/h1-4,7-10,16H,5-6,11-12H2
InChIKeyGNUCEQXCTASSID-UHFFFAOYSA-N
XLogP2.95
TPSA33.20 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.33
LogP ≤ 52.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-cyclopropyl-N-[(4-fluorophenyl)methyl]-2-(4-methylphenyl)acetamide
CID 78814100
N-cyclopropyl-4-[[cyclopropyl-[2-(4-fluorophenyl)acetyl]amino]methyl]benzamide
CID 34178957
N-[(4-fluorophenyl)methyl]-N-(pyridin-4-ylmethyl)cyclopropanamine
CID 122134073
N-[[4-(aminomethyl)phenyl]methyl]-N-(1-methylpiperidin-4-yl)-2-pyridin-4-ylacetamide
CID 174663762
3-[cyclopropyl(pyridin-4-ylmethyl)amino]-3-oxopropanoic acid
CID 62230754
N-(3-aminopropyl)-N-cyclopropyl-2-(4-fluorophenyl)acetamide
CID 43136754
N-cyclopropyl-3,5-difluoro-N-(pyridin-4-ylmethyl)benzamide
CID 47017136
N-cyclopropyl-N-[(4-fluorophenyl)methyl]-2-(2-nitrophenyl)acetamide
CID 18133640
1-(4-fluorophenyl)-3-pyridin-4-ylpropan-2-one
CID 62551750
6-[cyclopropyl(pyridin-4-ylmethyl)amino]-6-oxohexanoic acid
CID 60953865
N-cyclopropyl-2-(4-methyl-2-sulfanylidene-3H-1,3-thiazol-5-yl)-N-(pyridin-4-ylmethyl)acetamide
CID 75493656
N-cyclopentyl-N-ethyl-2-(4-fluorophenyl)acetamide
CID 86926966

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-2-(4-fluorophenyl)-N-(pyridin-4-ylmethyl)acetamide?
The IUPAC name of N-cyclopropyl-2-(4-fluorophenyl)-N-(pyridin-4-ylmethyl)acetamide (CID 47011276) is N-cyclopropyl-2-(4-fluorophenyl)-N-(pyridin-4-ylmethyl)acetamide.
What is the SMILES notation for N-cyclopropyl-2-(4-fluorophenyl)-N-(pyridin-4-ylmethyl)acetamide?
The canonical SMILES for N-cyclopropyl-2-(4-fluorophenyl)-N-(pyridin-4-ylmethyl)acetamide is O=C(Cc1ccc(F)cc1)N(Cc1ccncc1)C1CC1.
What is the InChIKey of N-cyclopropyl-2-(4-fluorophenyl)-N-(pyridin-4-ylmethyl)acetamide?
The InChIKey is GNUCEQXCTASSID-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17FN2O/c18-15-3-1-13(2-4-15)11-17(21)20(16-5-6-16)12-14-7-9-19-10-8-14/h1-4,7-10,16H,5-6,11-12H2.
What are the key properties of N-cyclopropyl-2-(4-fluorophenyl)-N-(pyridin-4-ylmethyl)acetamide?
N-cyclopropyl-2-(4-fluorophenyl)-N-(pyridin-4-ylmethyl)acetamide has a molecular weight of 284.33 g/mol, XLogP of 2.95, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-2-(4-fluorophenyl)-N-(pyridin-4-ylmethyl)acetamide is sourced from PubChem (CID 47011276), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).