N-(3,4-difluorophenyl)-2-[(4-propan-2-yloxyphenyl)sulfonylamino]acetamide

C17H18F2N2O4S — CID 113002373

IUPACN-(3,4-difluorophenyl)-2-[(4-propan-2-yloxyphenyl)sulfonylamino]acetamide
SMILESCC(C)Oc1ccc(S(=O)(=O)NCC(=O)Nc2ccc(F)c(F)c2)cc1
InChIInChI=1S/C17H18F2N2O4S/c1-11(2)25-13-4-6-14(7-5-13)26(23,24)20-10-17(22)21-12-3-8-15(18)16(19)9-12/h3-9,11,20H,10H2,1-2H3,(H,21,22)
InChIKeyDQGKUHUSBCYUAZ-UHFFFAOYSA-N
MW384.40 g/mol
LogP2.67
Rot. Bonds7

About N-(3,4-difluorophenyl)-2-[(4-propan-2-yloxyphenyl)sulfonylamino]acetamide

N-(3,4-difluorophenyl)-2-[(4-propan-2-yloxyphenyl)sulfonylamino]acetamide (PubChem CID 113002373) has the molecular formula C17H18F2N2O4S and a molecular weight of 384.40 g/mol. Its IUPAC name is N-(3,4-difluorophenyl)-2-[(4-propan-2-yloxyphenyl)sulfonylamino]acetamide.

Molecular Properties

Compound NameN-(3,4-difluorophenyl)-2-[(4-propan-2-yloxyphenyl)sulfonylamino]acetamide
PubChem CID113002373
Molecular FormulaC17H18F2N2O4S
Molecular Weight384.40 g/mol
Exact Mass384.10
IUPAC NameN-(3,4-difluorophenyl)-2-[(4-propan-2-yloxyphenyl)sulfonylamino]acetamide
SMILESCC(C)Oc1ccc(S(=O)(=O)NCC(=O)Nc2ccc(F)c(F)c2)cc1
InChIInChI=1S/C17H18F2N2O4S/c1-11(2)25-13-4-6-14(7-5-13)26(23,24)20-10-17(22)21-12-3-8-15(18)16(19)9-12/h3-9,11,20H,10H2,1-2H3,(H,21,22)
InChIKeyDQGKUHUSBCYUAZ-UHFFFAOYSA-N
XLogP2.67
TPSA84.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500384.40
LogP ≤ 52.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(4-methoxyphenyl)-2-[(4-propan-2-yloxyphenyl)sulfonylamino]acetamide
CID 112998764
N-(4-ethoxyphenyl)-2-[(4-propan-2-yloxyphenyl)sulfonylamino]acetamide
CID 112998900
N-(3,4-difluorophenyl)-3-[(4-ethoxyphenyl)sulfonylamino]propanamide
CID 26694786
N-[2-(3,4-difluoroanilino)-2-oxoethyl]-3-[[4-(trifluoromethoxy)phenyl]sulfonylamino]propanamide
CID 26560503
[2-(3,4-difluoroanilino)-2-oxoethyl] 2-[(3,4-dimethylphenyl)sulfonylamino]acetate
CID 7234598
N-(3,4-difluorophenyl)-2-[(2-methylphenyl)sulfonylamino]acetamide
CID 113002375
N-(3,4-difluorophenyl)-2-[(2-methoxy-4,5-dimethylphenyl)sulfonylamino]acetamide
CID 113002363
N-(4-methoxyphenyl)-2-[(4-propan-2-ylphenyl)sulfonylamino]acetamide
CID 112998738
2-[(4-propan-2-yloxyphenyl)sulfonylamino]-N-prop-2-enylacetamide
CID 112990609
[(2S)-1-(3,4-difluoroanilino)-1-oxopropan-2-yl] 2-(benzenesulfonamido)acetate
CID 8736148
N-(2-cyanophenyl)-2-[(4-propan-2-yloxyphenyl)sulfonylamino]acetamide
CID 113001906
N-(3,4-difluorophenyl)-2-[4-[(3,5-dimethylphenyl)sulfamoyl]phenoxy]acetamide
CID 28553530

Frequently Asked Questions

What is the IUPAC name of N-(3,4-difluorophenyl)-2-[(4-propan-2-yloxyphenyl)sulfonylamino]acetamide?
The IUPAC name of N-(3,4-difluorophenyl)-2-[(4-propan-2-yloxyphenyl)sulfonylamino]acetamide (CID 113002373) is N-(3,4-difluorophenyl)-2-[(4-propan-2-yloxyphenyl)sulfonylamino]acetamide.
What is the SMILES notation for N-(3,4-difluorophenyl)-2-[(4-propan-2-yloxyphenyl)sulfonylamino]acetamide?
The canonical SMILES for N-(3,4-difluorophenyl)-2-[(4-propan-2-yloxyphenyl)sulfonylamino]acetamide is CC(C)Oc1ccc(S(=O)(=O)NCC(=O)Nc2ccc(F)c(F)c2)cc1.
What is the InChIKey of N-(3,4-difluorophenyl)-2-[(4-propan-2-yloxyphenyl)sulfonylamino]acetamide?
The InChIKey is DQGKUHUSBCYUAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18F2N2O4S/c1-11(2)25-13-4-6-14(7-5-13)26(23,24)20-10-17(22)21-12-3-8-15(18)16(19)9-12/h3-9,11,20H,10H2,1-2H3,(H,21,22).
What are the key properties of N-(3,4-difluorophenyl)-2-[(4-propan-2-yloxyphenyl)sulfonylamino]acetamide?
N-(3,4-difluorophenyl)-2-[(4-propan-2-yloxyphenyl)sulfonylamino]acetamide has a molecular weight of 384.40 g/mol, XLogP of 2.67, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,4-difluorophenyl)-2-[(4-propan-2-yloxyphenyl)sulfonylamino]acetamide is sourced from PubChem (CID 113002373), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).