N-(3-fluoro-5-propan-2-ylphenyl)acetamide

C11H14FNO — CID 139423265

IUPACN-(3-fluoro-5-propan-2-ylphenyl)acetamide
SMILESCC(=O)Nc1cc(F)cc(C(C)C)c1
InChIInChI=1S/C11H14FNO/c1-7(2)9-4-10(12)6-11(5-9)13-8(3)14/h4-7H,1-3H3,(H,13,14)
InChIKeyKSKBELVWOYYSPR-UHFFFAOYSA-N
MW195.24 g/mol
LogP2.91
Rot. Bonds2

About N-(3-fluoro-5-propan-2-ylphenyl)acetamide

N-(3-fluoro-5-propan-2-ylphenyl)acetamide (PubChem CID 139423265) has the molecular formula C11H14FNO and a molecular weight of 195.24 g/mol. Its IUPAC name is N-(3-fluoro-5-propan-2-ylphenyl)acetamide.

Molecular Properties

Compound NameN-(3-fluoro-5-propan-2-ylphenyl)acetamide
PubChem CID139423265
Molecular FormulaC11H14FNO
Molecular Weight195.24 g/mol
Exact Mass195.11
IUPAC NameN-(3-fluoro-5-propan-2-ylphenyl)acetamide
SMILESCC(=O)Nc1cc(F)cc(C(C)C)c1
InChIInChI=1S/C11H14FNO/c1-7(2)9-4-10(12)6-11(5-9)13-8(3)14/h4-7H,1-3H3,(H,13,14)
InChIKeyKSKBELVWOYYSPR-UHFFFAOYSA-N
XLogP2.91
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.24
LogP ≤ 52.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-(3-fluoro-5-pentan-2-ylphenyl)acetamide
CID 155396943
3-fluoro-N,5-di(propan-2-yl)aniline
CID 130224455
N-(3,5-diacetamidophenyl)acetamide
CID 12731559
methyl 3-fluoro-5-propan-2-ylbenzoate
CID 103186417
3-acetamido-5-fluoro-N-hydroxybenzamide
CID 87663336
N-(6-acetamido-4-propan-2-yl-2-pyridinyl)acetamide
CID 146385375
N-(3,5-difluorophenyl)-3-methylbutanamide
CID 2987889
3,5-difluoro-N-(4-propan-2-ylphenyl)benzamide
CID 4785745
N-(3,5-difluorophenyl)-3-oxobutanamide
CID 18072687
3-acetamido-N-(3,5-difluorophenyl)benzamide
CID 17427227
1-(difluoromethyl)-3-fluoro-5-propan-2-ylbenzene
CID 118404669
2-amino-1-(3-fluoro-5-propan-2-ylphenyl)ethanone
CID 84773566

Frequently Asked Questions

What is the IUPAC name of N-(3-fluoro-5-propan-2-ylphenyl)acetamide?
The IUPAC name of N-(3-fluoro-5-propan-2-ylphenyl)acetamide (CID 139423265) is N-(3-fluoro-5-propan-2-ylphenyl)acetamide.
What is the SMILES notation for N-(3-fluoro-5-propan-2-ylphenyl)acetamide?
The canonical SMILES for N-(3-fluoro-5-propan-2-ylphenyl)acetamide is CC(=O)Nc1cc(F)cc(C(C)C)c1.
What is the InChIKey of N-(3-fluoro-5-propan-2-ylphenyl)acetamide?
The InChIKey is KSKBELVWOYYSPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14FNO/c1-7(2)9-4-10(12)6-11(5-9)13-8(3)14/h4-7H,1-3H3,(H,13,14).
What are the key properties of N-(3-fluoro-5-propan-2-ylphenyl)acetamide?
N-(3-fluoro-5-propan-2-ylphenyl)acetamide has a molecular weight of 195.24 g/mol, XLogP of 2.91, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-fluoro-5-propan-2-ylphenyl)acetamide is sourced from PubChem (CID 139423265), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).