N-propan-2-yl-2-(4-sulfamoylphenoxy)propanamide

C12H18N2O4S — CID 6461312

IUPACN-propan-2-yl-2-(4-sulfamoylphenoxy)propanamide
SMILESCC(C)NC(=O)C(C)Oc1ccc(S(N)(=O)=O)cc1
InChIInChI=1S/C12H18N2O4S/c1-8(2)14-12(15)9(3)18-10-4-6-11(7-5-10)19(13,16)17/h4-9H,1-3H3,(H,14,15)(H2,13,16,17)
InChIKeySEZDRPBXFNSPHD-UHFFFAOYSA-N
MW286.35 g/mol
LogP0.63
Rot. Bonds5

About N-propan-2-yl-2-(4-sulfamoylphenoxy)propanamide

N-propan-2-yl-2-(4-sulfamoylphenoxy)propanamide (PubChem CID 6461312) has the molecular formula C12H18N2O4S and a molecular weight of 286.35 g/mol. Its IUPAC name is N-propan-2-yl-2-(4-sulfamoylphenoxy)propanamide.

Molecular Properties

Compound NameN-propan-2-yl-2-(4-sulfamoylphenoxy)propanamide
PubChem CID6461312
Molecular FormulaC12H18N2O4S
Molecular Weight286.35 g/mol
Exact Mass286.10
IUPAC NameN-propan-2-yl-2-(4-sulfamoylphenoxy)propanamide
SMILESCC(C)NC(=O)C(C)Oc1ccc(S(N)(=O)=O)cc1
InChIInChI=1S/C12H18N2O4S/c1-8(2)14-12(15)9(3)18-10-4-6-11(7-5-10)19(13,16)17/h4-9H,1-3H3,(H,14,15)(H2,13,16,17)
InChIKeySEZDRPBXFNSPHD-UHFFFAOYSA-N
XLogP0.63
TPSA98.49 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.35
LogP ≤ 50.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-propan-2-yl-2-(4-sulfamoylphenoxy)propanamide?
The IUPAC name of N-propan-2-yl-2-(4-sulfamoylphenoxy)propanamide (CID 6461312) is N-propan-2-yl-2-(4-sulfamoylphenoxy)propanamide.
What is the SMILES notation for N-propan-2-yl-2-(4-sulfamoylphenoxy)propanamide?
The canonical SMILES for N-propan-2-yl-2-(4-sulfamoylphenoxy)propanamide is CC(C)NC(=O)C(C)Oc1ccc(S(N)(=O)=O)cc1.
What is the InChIKey of N-propan-2-yl-2-(4-sulfamoylphenoxy)propanamide?
The InChIKey is SEZDRPBXFNSPHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O4S/c1-8(2)14-12(15)9(3)18-10-4-6-11(7-5-10)19(13,16)17/h4-9H,1-3H3,(H,14,15)(H2,13,16,17).
What are the key properties of N-propan-2-yl-2-(4-sulfamoylphenoxy)propanamide?
N-propan-2-yl-2-(4-sulfamoylphenoxy)propanamide has a molecular weight of 286.35 g/mol, XLogP of 0.63, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-propan-2-yl-2-(4-sulfamoylphenoxy)propanamide is sourced from PubChem (CID 6461312), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).