3-(3-fluorophenyl)-N,3-dihydroxy-N-methylpropanamide

C10H12FNO3 — CID 155562391

IUPAC3-(3-fluorophenyl)-N,3-dihydroxy-N-methylpropanamide
SMILESCN(O)C(=O)CC(O)c1cccc(F)c1
InChIInChI=1S/C10H12FNO3/c1-12(15)10(14)6-9(13)7-3-2-4-8(11)5-7/h2-5,9,13,15H,6H2,1H3
InChIKeyLJLOTHHWPINGNI-UHFFFAOYSA-N
MW213.21 g/mol
LogP1.10
Rot. Bonds3

About 3-(3-fluorophenyl)-N,3-dihydroxy-N-methylpropanamide

3-(3-fluorophenyl)-N,3-dihydroxy-N-methylpropanamide (PubChem CID 155562391) has the molecular formula C10H12FNO3 and a molecular weight of 213.21 g/mol. Its IUPAC name is 3-(3-fluorophenyl)-N,3-dihydroxy-N-methylpropanamide.

Molecular Properties

Compound Name3-(3-fluorophenyl)-N,3-dihydroxy-N-methylpropanamide
PubChem CID155562391
Molecular FormulaC10H12FNO3
Molecular Weight213.21 g/mol
Exact Mass213.08
IUPAC Name3-(3-fluorophenyl)-N,3-dihydroxy-N-methylpropanamide
SMILESCN(O)C(=O)CC(O)c1cccc(F)c1
InChIInChI=1S/C10H12FNO3/c1-12(15)10(14)6-9(13)7-3-2-4-8(11)5-7/h2-5,9,13,15H,6H2,1H3
InChIKeyLJLOTHHWPINGNI-UHFFFAOYSA-N
XLogP1.10
TPSA60.77 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.21
LogP ≤ 51.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydroxamic_acid', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

3-(2-fluorophenyl)-N,3-dihydroxypropanamide
CID 72707600
3-(3-fluorophenyl)-N,3-dihydroxypropanamide
CID 72707603
N,3-dihydroxy-3-[3-(trifluoromethyl)phenyl]propanamide
CID 72707664
3-(4-fluorophenyl)-N,3-dihydroxypropanamide
CID 72707668
N,3-dihydroxy-3-[4-(trifluoromethyl)phenyl]propanamide
CID 72707669
N,3-dihydroxy-3-phenylpropanamide
CID 71721720
3-(4-fluorophenyl)-N,3-dihydroxy-N-methylpropanamide
CID 155514177
3-(4-bromophenyl)-N,3-dihydroxy-N-methylpropanamide
CID 155528209
3-(3-bromophenyl)-N,3-dihydroxy-N-methylpropanamide
CID 155534689
3-(4-chlorophenyl)-N,3-dihydroxy-N-methylpropanamide
CID 155536133
3-(3-chlorophenyl)-N,3-dihydroxy-N-methylpropanamide
CID 155540829
3-(2-chlorophenyl)-N,3-dihydroxy-N-methylpropanamide
CID 155557124

Frequently Asked Questions

What is the IUPAC name of 3-(3-fluorophenyl)-N,3-dihydroxy-N-methylpropanamide?
The IUPAC name of 3-(3-fluorophenyl)-N,3-dihydroxy-N-methylpropanamide (CID 155562391) is 3-(3-fluorophenyl)-N,3-dihydroxy-N-methylpropanamide.
What is the SMILES notation for 3-(3-fluorophenyl)-N,3-dihydroxy-N-methylpropanamide?
The canonical SMILES for 3-(3-fluorophenyl)-N,3-dihydroxy-N-methylpropanamide is CN(O)C(=O)CC(O)c1cccc(F)c1.
What is the InChIKey of 3-(3-fluorophenyl)-N,3-dihydroxy-N-methylpropanamide?
The InChIKey is LJLOTHHWPINGNI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12FNO3/c1-12(15)10(14)6-9(13)7-3-2-4-8(11)5-7/h2-5,9,13,15H,6H2,1H3.
What are the key properties of 3-(3-fluorophenyl)-N,3-dihydroxy-N-methylpropanamide?
3-(3-fluorophenyl)-N,3-dihydroxy-N-methylpropanamide has a molecular weight of 213.21 g/mol, XLogP of 1.10, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-fluorophenyl)-N,3-dihydroxy-N-methylpropanamide is sourced from PubChem (CID 155562391), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).