2-cyclopropyl-N-(2-fluoro-4-hydroxyphenyl)propanamide

C12H14FNO2 — CID 83154239

IUPAC2-cyclopropyl-N-(2-fluoro-4-hydroxyphenyl)propanamide
SMILESCC(C(=O)Nc1ccc(O)cc1F)C1CC1
InChIInChI=1S/C12H14FNO2/c1-7(8-2-3-8)12(16)14-11-5-4-9(15)6-10(11)13/h4-8,15H,2-3H2,1H3,(H,14,16)
InChIKeyMJNHPVPRXLZULH-UHFFFAOYSA-N
MW223.25 g/mol
LogP2.52
Rot. Bonds3

About 2-cyclopropyl-N-(2-fluoro-4-hydroxyphenyl)propanamide

2-cyclopropyl-N-(2-fluoro-4-hydroxyphenyl)propanamide (PubChem CID 83154239) has the molecular formula C12H14FNO2 and a molecular weight of 223.25 g/mol. Its IUPAC name is 2-cyclopropyl-N-(2-fluoro-4-hydroxyphenyl)propanamide.

Molecular Properties

Compound Name2-cyclopropyl-N-(2-fluoro-4-hydroxyphenyl)propanamide
PubChem CID83154239
Molecular FormulaC12H14FNO2
Molecular Weight223.25 g/mol
Exact Mass223.10
IUPAC Name2-cyclopropyl-N-(2-fluoro-4-hydroxyphenyl)propanamide
SMILESCC(C(=O)Nc1ccc(O)cc1F)C1CC1
InChIInChI=1S/C12H14FNO2/c1-7(8-2-3-8)12(16)14-11-5-4-9(15)6-10(11)13/h4-8,15H,2-3H2,1H3,(H,14,16)
InChIKeyMJNHPVPRXLZULH-UHFFFAOYSA-N
XLogP2.52
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.25
LogP ≤ 52.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-(2-cyclopropylpropanoylamino)-5-hydroxybenzoic acid
CID 83146824
2-cyclopropyl-N-[2-fluoro-4-(3-hydroxyprop-1-ynyl)phenyl]propanamide
CID 83149306
N-(5-amino-2,4-difluorophenyl)-2-cyclopropylpropanamide
CID 83147686
2-cyclopropyl-N-[2-fluoro-4-(4-hydroxybut-1-ynyl)phenyl]propanamide
CID 83148694
N-(2-fluoro-4-hydroxyphenyl)-2-phenylpropanamide
CID 104920662
2-cyclopropyl-N-(3,4-difluorophenyl)propanamide
CID 110428971
N-[4-amino-2-(trifluoromethyl)phenyl]-2-cyclopropylpropanamide
CID 83146901
N-(4-chlorophenyl)-4-[(2S)-1-(2,4-difluoroanilino)-1-oxopropan-2-yl]piperidine-1-carboxamide
CID 95065411
N-(2-carbamothioyl-3-fluorophenyl)-2-cyclopropylpropanamide
CID 83154703
4-(2-cyclopropylpropanoylamino)-3,5-difluorobenzenesulfonyl chloride
CID 83154456
N-(2-fluoro-4-hydroxyphenyl)-2,2-dimethylpropanamide
CID 64795167
2-(1-cyclopropylethylcarbamoylamino)-5-hydroxybenzoic acid
CID 61405929

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-N-(2-fluoro-4-hydroxyphenyl)propanamide?
The IUPAC name of 2-cyclopropyl-N-(2-fluoro-4-hydroxyphenyl)propanamide (CID 83154239) is 2-cyclopropyl-N-(2-fluoro-4-hydroxyphenyl)propanamide.
What is the SMILES notation for 2-cyclopropyl-N-(2-fluoro-4-hydroxyphenyl)propanamide?
The canonical SMILES for 2-cyclopropyl-N-(2-fluoro-4-hydroxyphenyl)propanamide is CC(C(=O)Nc1ccc(O)cc1F)C1CC1.
What is the InChIKey of 2-cyclopropyl-N-(2-fluoro-4-hydroxyphenyl)propanamide?
The InChIKey is MJNHPVPRXLZULH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14FNO2/c1-7(8-2-3-8)12(16)14-11-5-4-9(15)6-10(11)13/h4-8,15H,2-3H2,1H3,(H,14,16).
What are the key properties of 2-cyclopropyl-N-(2-fluoro-4-hydroxyphenyl)propanamide?
2-cyclopropyl-N-(2-fluoro-4-hydroxyphenyl)propanamide has a molecular weight of 223.25 g/mol, XLogP of 2.52, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-N-(2-fluoro-4-hydroxyphenyl)propanamide is sourced from PubChem (CID 83154239), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).