2-[cyclopropyl(methyl)amino]-N-(4-fluorophenyl)acetamide

C12H15FN2O — CID 47166447

IUPAC2-[cyclopropyl(methyl)amino]-N-(4-fluorophenyl)acetamide
SMILESCN(CC(=O)Nc1ccc(F)cc1)C1CC1
InChIInChI=1S/C12H15FN2O/c1-15(11-6-7-11)8-12(16)14-10-4-2-9(13)3-5-10/h2-5,11H,6-8H2,1H3,(H,14,16)
InChIKeyFXFPCYNSUAQZNZ-UHFFFAOYSA-N
MW222.26 g/mol
LogP1.86
Rot. Bonds4

About 2-[cyclopropyl(methyl)amino]-N-(4-fluorophenyl)acetamide

2-[cyclopropyl(methyl)amino]-N-(4-fluorophenyl)acetamide (PubChem CID 47166447) has the molecular formula C12H15FN2O and a molecular weight of 222.26 g/mol. Its IUPAC name is 2-[cyclopropyl(methyl)amino]-N-(4-fluorophenyl)acetamide.

Molecular Properties

Compound Name2-[cyclopropyl(methyl)amino]-N-(4-fluorophenyl)acetamide
PubChem CID47166447
Molecular FormulaC12H15FN2O
Molecular Weight222.26 g/mol
Exact Mass222.12
IUPAC Name2-[cyclopropyl(methyl)amino]-N-(4-fluorophenyl)acetamide
SMILESCN(CC(=O)Nc1ccc(F)cc1)C1CC1
InChIInChI=1S/C12H15FN2O/c1-15(11-6-7-11)8-12(16)14-10-4-2-9(13)3-5-10/h2-5,11H,6-8H2,1H3,(H,14,16)
InChIKeyFXFPCYNSUAQZNZ-UHFFFAOYSA-N
XLogP1.86
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.26
LogP ≤ 51.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(4-cyanophenyl)-2-[cyclopropyl(methyl)amino]acetamide
CID 43243615
2-[cyclopentyl(methylsulfonyl)amino]-N-(4-fluorophenyl)acetamide
CID 113148937
2-[cyclohexyl(methylsulfonyl)amino]-N-(4-fluorophenyl)acetamide
CID 2111492
2-[cycloheptyl(methyl)amino]-N-phenylacetamide
CID 16577724
2-[cyclohexyl(methyl)amino]-N-(3-fluorophenyl)acetamide
CID 4818308
2-[cyclopropyl-[(4-fluorophenyl)methyl]amino]-N-(4-methylphenyl)acetamide
CID 8872677
trans-(1R,2R)-N-[2-(4-fluoroanilino)-2-oxoethyl]-N,2-dimethylcyclopropane-1-carboxamide
CID 9441278
2-[methyl-(4-oxocyclohexyl)amino]-N-(4-methylphenyl)acetamide
CID 79119762
N-(4-cyanophenyl)-2-[methyl(piperidin-4-yl)amino]acetamide
CID 43607310
2-[[2-(4-fluoroanilino)-2-oxoethyl]-methylamino]-N-phenylacetamide
CID 2608827
N-[4-(dimethylamino)phenyl]-2-[methyl-(1-methylpiperidin-4-yl)amino]acetamide
CID 2095190
2-[methyl-(4-methylcyclohexyl)amino]-N-(4-nitrophenyl)acetamide
CID 55381834

Frequently Asked Questions

What is the IUPAC name of 2-[cyclopropyl(methyl)amino]-N-(4-fluorophenyl)acetamide?
The IUPAC name of 2-[cyclopropyl(methyl)amino]-N-(4-fluorophenyl)acetamide (CID 47166447) is 2-[cyclopropyl(methyl)amino]-N-(4-fluorophenyl)acetamide.
What is the SMILES notation for 2-[cyclopropyl(methyl)amino]-N-(4-fluorophenyl)acetamide?
The canonical SMILES for 2-[cyclopropyl(methyl)amino]-N-(4-fluorophenyl)acetamide is CN(CC(=O)Nc1ccc(F)cc1)C1CC1.
What is the InChIKey of 2-[cyclopropyl(methyl)amino]-N-(4-fluorophenyl)acetamide?
The InChIKey is FXFPCYNSUAQZNZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15FN2O/c1-15(11-6-7-11)8-12(16)14-10-4-2-9(13)3-5-10/h2-5,11H,6-8H2,1H3,(H,14,16).
What are the key properties of 2-[cyclopropyl(methyl)amino]-N-(4-fluorophenyl)acetamide?
2-[cyclopropyl(methyl)amino]-N-(4-fluorophenyl)acetamide has a molecular weight of 222.26 g/mol, XLogP of 1.86, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[cyclopropyl(methyl)amino]-N-(4-fluorophenyl)acetamide is sourced from PubChem (CID 47166447), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).