2-amino-N-(4-fluoro-3-morpholin-4-ylsulfonylphenyl)acetamide

C12H16FN3O4S — CID 119265799

IUPAC2-amino-N-(4-fluoro-3-morpholin-4-ylsulfonylphenyl)acetamide
SMILESNCC(=O)Nc1ccc(F)c(S(=O)(=O)N2CCOCC2)c1
InChIInChI=1S/C12H16FN3O4S/c13-10-2-1-9(15-12(17)8-14)7-11(10)21(18,19)16-3-5-20-6-4-16/h1-2,7H,3-6,8,14H2,(H,15,17)
InChIKeyFIEKRKWKSOUIKY-UHFFFAOYSA-N
MW317.34 g/mol
LogP-0.26
Rot. Bonds4

About 2-amino-N-(4-fluoro-3-morpholin-4-ylsulfonylphenyl)acetamide

2-amino-N-(4-fluoro-3-morpholin-4-ylsulfonylphenyl)acetamide (PubChem CID 119265799) has the molecular formula C12H16FN3O4S and a molecular weight of 317.34 g/mol. Its IUPAC name is 2-amino-N-(4-fluoro-3-morpholin-4-ylsulfonylphenyl)acetamide.

Molecular Properties

Compound Name2-amino-N-(4-fluoro-3-morpholin-4-ylsulfonylphenyl)acetamide
PubChem CID119265799
Molecular FormulaC12H16FN3O4S
Molecular Weight317.34 g/mol
Exact Mass317.08
IUPAC Name2-amino-N-(4-fluoro-3-morpholin-4-ylsulfonylphenyl)acetamide
SMILESNCC(=O)Nc1ccc(F)c(S(=O)(=O)N2CCOCC2)c1
InChIInChI=1S/C12H16FN3O4S/c13-10-2-1-9(15-12(17)8-14)7-11(10)21(18,19)16-3-5-20-6-4-16/h1-2,7H,3-6,8,14H2,(H,15,17)
InChIKeyFIEKRKWKSOUIKY-UHFFFAOYSA-N
XLogP-0.26
TPSA101.73 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.34
LogP ≤ 5-0.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-amino-N-(4-fluoro-3-morpholin-4-ylsulfonylphenyl)acetamide;hydrochloride
CID 119265798
2-(4-aminophenyl)-N-(4-fluoro-3-morpholin-4-ylsulfonylphenyl)acetamide;hydrochloride
CID 119678981
N-(4-fluoro-3-morpholin-4-ylsulfonylphenyl)-2-naphthalen-1-ylacetamide
CID 18158882
1-amino-N-(4-fluoro-3-morpholin-4-ylsulfonylphenyl)cyclopentane-1-carboxamide
CID 119265809
2-[(1S,2R,4S)-2-bicyclo[2.2.1]heptanyl]-N-(4-fluoro-3-morpholin-4-ylsulfonylphenyl)acetamide
CID 98599209
N-(4-fluoro-3-morpholin-4-ylsulfonylphenyl)-3-(oxolan-2-yl)propanamide
CID 55605507
2,4-difluoro-N-(4-fluoro-3-morpholin-4-ylsulfonylphenyl)benzamide
CID 55341430
4-ethyl-N-(4-fluoro-3-morpholin-4-ylsulfonylphenyl)benzamide
CID 18158878
N-(4-fluoro-3-morpholin-4-ylsulfonylphenyl)furan-2-carboxamide
CID 51154323
2-[(4-fluoro-3-morpholin-4-ylsulfonylphenyl)carbamoyl]cyclobutane-1-carboxylic acid
CID 120974368
4-[(4-fluoro-3-morpholin-4-ylsulfonylphenyl)carbamoylamino]butanoic acid
CID 122076915
2-(4-chloro-3,5-dimethylpyrazol-1-yl)-N-(4-fluoro-3-morpholin-4-ylsulfonylphenyl)acetamide
CID 55923829

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(4-fluoro-3-morpholin-4-ylsulfonylphenyl)acetamide?
The IUPAC name of 2-amino-N-(4-fluoro-3-morpholin-4-ylsulfonylphenyl)acetamide (CID 119265799) is 2-amino-N-(4-fluoro-3-morpholin-4-ylsulfonylphenyl)acetamide.
What is the SMILES notation for 2-amino-N-(4-fluoro-3-morpholin-4-ylsulfonylphenyl)acetamide?
The canonical SMILES for 2-amino-N-(4-fluoro-3-morpholin-4-ylsulfonylphenyl)acetamide is NCC(=O)Nc1ccc(F)c(S(=O)(=O)N2CCOCC2)c1.
What is the InChIKey of 2-amino-N-(4-fluoro-3-morpholin-4-ylsulfonylphenyl)acetamide?
The InChIKey is FIEKRKWKSOUIKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16FN3O4S/c13-10-2-1-9(15-12(17)8-14)7-11(10)21(18,19)16-3-5-20-6-4-16/h1-2,7H,3-6,8,14H2,(H,15,17).
What are the key properties of 2-amino-N-(4-fluoro-3-morpholin-4-ylsulfonylphenyl)acetamide?
2-amino-N-(4-fluoro-3-morpholin-4-ylsulfonylphenyl)acetamide has a molecular weight of 317.34 g/mol, XLogP of -0.26, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(4-fluoro-3-morpholin-4-ylsulfonylphenyl)acetamide is sourced from PubChem (CID 119265799), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).