N-(4-fluorophenyl)-N-propan-2-ylpropanamide

C12H16FNO — CID 18339665

IUPACN-(4-fluorophenyl)-N-propan-2-ylpropanamide
SMILESCCC(=O)N(c1ccc(F)cc1)C(C)C
InChIInChI=1S/C12H16FNO/c1-4-12(15)14(9(2)3)11-7-5-10(13)6-8-11/h5-9H,4H2,1-3H3
InChIKeyBWERDZIRMCUQMC-UHFFFAOYSA-N
MW209.26 g/mol
LogP2.98
Rot. Bonds3

About N-(4-fluorophenyl)-N-propan-2-ylpropanamide

N-(4-fluorophenyl)-N-propan-2-ylpropanamide (PubChem CID 18339665) has the molecular formula C12H16FNO and a molecular weight of 209.26 g/mol. Its IUPAC name is N-(4-fluorophenyl)-N-propan-2-ylpropanamide.

Molecular Properties

Compound NameN-(4-fluorophenyl)-N-propan-2-ylpropanamide
PubChem CID18339665
Molecular FormulaC12H16FNO
Molecular Weight209.26 g/mol
Exact Mass209.12
IUPAC NameN-(4-fluorophenyl)-N-propan-2-ylpropanamide
SMILESCCC(=O)N(c1ccc(F)cc1)C(C)C
InChIInChI=1S/C12H16FNO/c1-4-12(15)14(9(2)3)11-7-5-10(13)6-8-11/h5-9H,4H2,1-3H3
InChIKeyBWERDZIRMCUQMC-UHFFFAOYSA-N
XLogP2.98
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.26
LogP ≤ 52.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

N-(4-fluoro(1,2,3,4,5,6-13C6)cyclohexa-1,3,5-trien-1-yl)-2-hydroxy-N-propan-2-ylacetamide
CID 169440701
ethyl N-(4-fluorophenyl)-N-propan-2-ylcarbamate
CID 117061413
[2-(4-fluoro-N-propan-2-ylanilino)-2-oxoethyl] acetate
CID 10220637
N-(4-fluorophenyl)-N-propan-2-ylacetamide;bis(trihydroxy(sulfanylidene)-λ5-phosphane)
CID 88710742
[2-(4-fluoro-N-propan-2-ylanilino)-1-hydroxy-2-oxoethyl] acetate
CID 140995964
N-ethyl-N-(4-fluorophenyl)-4-hydroxypentanamide
CID 79192647
2-(N-ethyl-4-fluoroanilino)pentan-3-one
CID 64866058
2-(4-fluoro-N-(4-fluorophenyl)anilino)propanoic acid
CID 139511058
2-(1,3-benzothiazol-2-yloxy)-N-(4-fluorophenyl)-N-propan-2-ylacetamide
CID 139069972
2-[[5-chloro-1-(difluoromethyl)-1,3,4-thiadiazol-1-ium-2-yl]oxy]-N-(4-fluorophenyl)-N-propan-2-ylacetamide
CID 162568255
sodium;N-(4-fluorophenyl)-N-propan-2-yl-2-[[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]oxy]acetamide;hydride
CID 173247368
N-ethyl-N-(4-fluorophenyl)-2-(propan-2-ylamino)acetamide
CID 60683040

Frequently Asked Questions

What is the IUPAC name of N-(4-fluorophenyl)-N-propan-2-ylpropanamide?
The IUPAC name of N-(4-fluorophenyl)-N-propan-2-ylpropanamide (CID 18339665) is N-(4-fluorophenyl)-N-propan-2-ylpropanamide.
What is the SMILES notation for N-(4-fluorophenyl)-N-propan-2-ylpropanamide?
The canonical SMILES for N-(4-fluorophenyl)-N-propan-2-ylpropanamide is CCC(=O)N(c1ccc(F)cc1)C(C)C.
What is the InChIKey of N-(4-fluorophenyl)-N-propan-2-ylpropanamide?
The InChIKey is BWERDZIRMCUQMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16FNO/c1-4-12(15)14(9(2)3)11-7-5-10(13)6-8-11/h5-9H,4H2,1-3H3.
What are the key properties of N-(4-fluorophenyl)-N-propan-2-ylpropanamide?
N-(4-fluorophenyl)-N-propan-2-ylpropanamide has a molecular weight of 209.26 g/mol, XLogP of 2.98, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-fluorophenyl)-N-propan-2-ylpropanamide is sourced from PubChem (CID 18339665), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).