3-fluoro-N-naphthalen-1-ylpropanamide

C13H12FNO — CID 67224476

IUPAC3-fluoro-N-naphthalen-1-ylpropanamide
SMILESO=C(CCF)Nc1cccc2ccccc12
InChIInChI=1S/C13H12FNO/c14-9-8-13(16)15-12-7-3-5-10-4-1-2-6-11(10)12/h1-7H,8-9H2,(H,15,16)
InChIKeyODKGZDUYOBZPQR-UHFFFAOYSA-N
MW217.24 g/mol
LogP3.14
Rot. Bonds3

About 3-fluoro-N-naphthalen-1-ylpropanamide

3-fluoro-N-naphthalen-1-ylpropanamide (PubChem CID 67224476) has the molecular formula C13H12FNO and a molecular weight of 217.24 g/mol. Its IUPAC name is 3-fluoro-N-naphthalen-1-ylpropanamide.

Molecular Properties

Compound Name3-fluoro-N-naphthalen-1-ylpropanamide
PubChem CID67224476
Molecular FormulaC13H12FNO
Molecular Weight217.24 g/mol
Exact Mass217.09
IUPAC Name3-fluoro-N-naphthalen-1-ylpropanamide
SMILESO=C(CCF)Nc1cccc2ccccc12
InChIInChI=1S/C13H12FNO/c14-9-8-13(16)15-12-7-3-5-10-4-1-2-6-11(10)12/h1-7H,8-9H2,(H,15,16)
InChIKeyODKGZDUYOBZPQR-UHFFFAOYSA-N
XLogP3.14
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.24
LogP ≤ 53.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N,N'-dinaphthalen-1-ylbutanediamide
CID 1346643
2-amino-N-naphthalen-1-ylacetamide;hydrochloride
CID 47003070
1-naphthalen-1-yl-3-[2-(naphthalen-1-ylcarbamoylamino)phenyl]urea
CID 177491059
1-naphthalen-1-yl-3-[5-(naphthalen-1-ylcarbamoylamino)naphthalen-1-yl]urea
CID 27190755
N-naphthalen-1-yldodecanamide
CID 588517
3-methylsulfonyl-N-naphthalen-1-ylpropanamide
CID 127504646
2-(2-fluorophenyl)-N-naphthalen-1-ylacetamide
CID 836511
naphthalen-1-ylurea;hydrochloride
CID 141142203
2-anilino-N-naphthalen-1-ylacetamide
CID 767556
N-naphthalen-1-yl-2-naphthalen-2-ylacetamide
CID 16849654
3-phenyl-N-[5-(3-phenylpropanoylamino)naphthalen-1-yl]propanamide
CID 1010239
3-(4-fluorophenyl)sulfonyl-N-naphthalen-1-ylpropanamide
CID 7254373

Frequently Asked Questions

What is the IUPAC name of 3-fluoro-N-naphthalen-1-ylpropanamide?
The IUPAC name of 3-fluoro-N-naphthalen-1-ylpropanamide (CID 67224476) is 3-fluoro-N-naphthalen-1-ylpropanamide.
What is the SMILES notation for 3-fluoro-N-naphthalen-1-ylpropanamide?
The canonical SMILES for 3-fluoro-N-naphthalen-1-ylpropanamide is O=C(CCF)Nc1cccc2ccccc12.
What is the InChIKey of 3-fluoro-N-naphthalen-1-ylpropanamide?
The InChIKey is ODKGZDUYOBZPQR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12FNO/c14-9-8-13(16)15-12-7-3-5-10-4-1-2-6-11(10)12/h1-7H,8-9H2,(H,15,16).
What are the key properties of 3-fluoro-N-naphthalen-1-ylpropanamide?
3-fluoro-N-naphthalen-1-ylpropanamide has a molecular weight of 217.24 g/mol, XLogP of 3.14, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoro-N-naphthalen-1-ylpropanamide is sourced from PubChem (CID 67224476), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).