1-fluoro-N-phenylmethanesulfinamide

C7H8FNOS — CID 141055772

IUPAC1-fluoro-N-phenylmethanesulfinamide
SMILESO=S(CF)Nc1ccccc1
InChIInChI=1S/C7H8FNOS/c8-6-11(10)9-7-4-2-1-3-5-7/h1-5,9H,6H2
InChIKeySVDAPAFFCOAQPE-UHFFFAOYSA-N
MW173.21 g/mol
LogP1.69
Rot. Bonds3

About 1-fluoro-N-phenylmethanesulfinamide

1-fluoro-N-phenylmethanesulfinamide (PubChem CID 141055772) has the molecular formula C7H8FNOS and a molecular weight of 173.21 g/mol. Its IUPAC name is 1-fluoro-N-phenylmethanesulfinamide.

Molecular Properties

Compound Name1-fluoro-N-phenylmethanesulfinamide
PubChem CID141055772
Molecular FormulaC7H8FNOS
Molecular Weight173.21 g/mol
Exact Mass173.03
IUPAC Name1-fluoro-N-phenylmethanesulfinamide
SMILESO=S(CF)Nc1ccccc1
InChIInChI=1S/C7H8FNOS/c8-6-11(10)9-7-4-2-1-3-5-7/h1-5,9H,6H2
InChIKeySVDAPAFFCOAQPE-UHFFFAOYSA-N
XLogP1.69
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.21
LogP ≤ 51.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(R)-N-phenylprop-1-yne-1-sulfinamide
CID 40532337
ethanamine;(sulfinatoamino)benzene
CID 68776959
4-(benzylsulfinylamino)benzoic acid
CID 70927651
(3-phenylanilino)methanesulfinate
CID 174442232
N'-phenylmethanesulfinohydrazide
CID 141009109
phenylsulfinamoyl acetate
CID 70492753
3-fluoro-N-phenylpropanamide
CID 70366284
disodium;N,N'-diphenylethane-1,2-diamine;hydride
CID 173210842
2-fluoro-N'-phenylacetohydrazide
CID 16862
N,N'-diphenylpropane-1,3-diamine;hydrochloride
CID 68721632
2-hydroxy-3-methyl-N-phenylbenzenesulfinamide
CID 21135285
2-(4-chlorophenyl)-N-phenylethenesulfinamide
CID 3716001

Frequently Asked Questions

What is the IUPAC name of 1-fluoro-N-phenylmethanesulfinamide?
The IUPAC name of 1-fluoro-N-phenylmethanesulfinamide (CID 141055772) is 1-fluoro-N-phenylmethanesulfinamide.
What is the SMILES notation for 1-fluoro-N-phenylmethanesulfinamide?
The canonical SMILES for 1-fluoro-N-phenylmethanesulfinamide is O=S(CF)Nc1ccccc1.
What is the InChIKey of 1-fluoro-N-phenylmethanesulfinamide?
The InChIKey is SVDAPAFFCOAQPE-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8FNOS/c8-6-11(10)9-7-4-2-1-3-5-7/h1-5,9H,6H2.
What are the key properties of 1-fluoro-N-phenylmethanesulfinamide?
1-fluoro-N-phenylmethanesulfinamide has a molecular weight of 173.21 g/mol, XLogP of 1.69, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-fluoro-N-phenylmethanesulfinamide is sourced from PubChem (CID 141055772), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).