2-(propan-2-ylamino)-N-(3-sulfamoylphenyl)acetamide

C11H17N3O3S — CID 60641008

IUPAC2-(propan-2-ylamino)-N-(3-sulfamoylphenyl)acetamide
SMILESCC(C)NCC(=O)Nc1cccc(S(N)(=O)=O)c1
InChIInChI=1S/C11H17N3O3S/c1-8(2)13-7-11(15)14-9-4-3-5-10(6-9)18(12,16)17/h3-6,8,13H,7H2,1-2H3,(H,14,15)(H2,12,16,17)
InChIKeyFXAMQTOJCRNVKH-UHFFFAOYSA-N
MW271.34 g/mol
LogP0.27
Rot. Bonds5

About 2-(propan-2-ylamino)-N-(3-sulfamoylphenyl)acetamide

2-(propan-2-ylamino)-N-(3-sulfamoylphenyl)acetamide (PubChem CID 60641008) has the molecular formula C11H17N3O3S and a molecular weight of 271.34 g/mol. Its IUPAC name is 2-(propan-2-ylamino)-N-(3-sulfamoylphenyl)acetamide.

Molecular Properties

Compound Name2-(propan-2-ylamino)-N-(3-sulfamoylphenyl)acetamide
PubChem CID60641008
Molecular FormulaC11H17N3O3S
Molecular Weight271.34 g/mol
Exact Mass271.10
IUPAC Name2-(propan-2-ylamino)-N-(3-sulfamoylphenyl)acetamide
SMILESCC(C)NCC(=O)Nc1cccc(S(N)(=O)=O)c1
InChIInChI=1S/C11H17N3O3S/c1-8(2)13-7-11(15)14-9-4-3-5-10(6-9)18(12,16)17/h3-6,8,13H,7H2,1-2H3,(H,14,15)(H2,12,16,17)
InChIKeyFXAMQTOJCRNVKH-UHFFFAOYSA-N
XLogP0.27
TPSA101.29 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.34
LogP ≤ 50.27
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-[3-(cyclopropylsulfamoyl)phenyl]-2-(propan-2-ylamino)acetamide
CID 60718564
N-[3-(methanesulfonamido)phenyl]-2-(propan-2-ylamino)acetamide
CID 61274883
3-[[2-(propan-2-ylamino)acetyl]amino]benzamide
CID 54817579
3-amino-N-(3-sulfamoylphenyl)-3-sulfanylidenepropanamide
CID 28942449
2-[ethyl-[2-oxo-2-(propan-2-ylamino)ethyl]amino]-N-(3-sulfamoylphenyl)acetamide
CID 39895252
(3S)-3-[(3-sulfamoylphenyl)carbamoylamino]butanoic acid
CID 129366210
(3R)-3-[(3-sulfamoylphenyl)carbamoylamino]butanoic acid
CID 129366211
3-chloro-2-methyl-N-(3-sulfamoylphenyl)propanamide
CID 55110486
N-(2-methoxy-5-sulfamoylphenyl)-2-(propan-2-ylamino)acetamide
CID 60842548
1-propan-2-yl-3-(3-sulfamoylphenyl)thiourea
CID 7991852
4-hydroxy-N-(3-sulfamoylphenyl)butanamide
CID 79200940
N-(2-methyl-3-sulfamoylphenyl)-2-(propan-2-ylamino)acetamide
CID 54863561

Frequently Asked Questions

What is the IUPAC name of 2-(propan-2-ylamino)-N-(3-sulfamoylphenyl)acetamide?
The IUPAC name of 2-(propan-2-ylamino)-N-(3-sulfamoylphenyl)acetamide (CID 60641008) is 2-(propan-2-ylamino)-N-(3-sulfamoylphenyl)acetamide.
What is the SMILES notation for 2-(propan-2-ylamino)-N-(3-sulfamoylphenyl)acetamide?
The canonical SMILES for 2-(propan-2-ylamino)-N-(3-sulfamoylphenyl)acetamide is CC(C)NCC(=O)Nc1cccc(S(N)(=O)=O)c1.
What is the InChIKey of 2-(propan-2-ylamino)-N-(3-sulfamoylphenyl)acetamide?
The InChIKey is FXAMQTOJCRNVKH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O3S/c1-8(2)13-7-11(15)14-9-4-3-5-10(6-9)18(12,16)17/h3-6,8,13H,7H2,1-2H3,(H,14,15)(H2,12,16,17).
What are the key properties of 2-(propan-2-ylamino)-N-(3-sulfamoylphenyl)acetamide?
2-(propan-2-ylamino)-N-(3-sulfamoylphenyl)acetamide has a molecular weight of 271.34 g/mol, XLogP of 0.27, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(propan-2-ylamino)-N-(3-sulfamoylphenyl)acetamide is sourced from PubChem (CID 60641008), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).