N,N-dimethyl-2-[(1-methylpyrazol-4-yl)sulfonylamino]propanamide

C9H16N4O3S — CID 47034944

IUPACN,N-dimethyl-2-[(1-methylpyrazol-4-yl)sulfonylamino]propanamide
SMILESCC(NS(=O)(=O)c1cnn(C)c1)C(=O)N(C)C
InChIInChI=1S/C9H16N4O3S/c1-7(9(14)12(2)3)11-17(15,16)8-5-10-13(4)6-8/h5-7,11H,1-4H3
InChIKeyONJSWXFUJGWOSI-UHFFFAOYSA-N
MW260.32 g/mol
LogP-0.82
Rot. Bonds4

About N,N-dimethyl-2-[(1-methylpyrazol-4-yl)sulfonylamino]propanamide

N,N-dimethyl-2-[(1-methylpyrazol-4-yl)sulfonylamino]propanamide (PubChem CID 47034944) has the molecular formula C9H16N4O3S and a molecular weight of 260.32 g/mol. Its IUPAC name is N,N-dimethyl-2-[(1-methylpyrazol-4-yl)sulfonylamino]propanamide.

Molecular Properties

Compound NameN,N-dimethyl-2-[(1-methylpyrazol-4-yl)sulfonylamino]propanamide
PubChem CID47034944
Molecular FormulaC9H16N4O3S
Molecular Weight260.32 g/mol
Exact Mass260.09
IUPAC NameN,N-dimethyl-2-[(1-methylpyrazol-4-yl)sulfonylamino]propanamide
SMILESCC(NS(=O)(=O)c1cnn(C)c1)C(=O)N(C)C
InChIInChI=1S/C9H16N4O3S/c1-7(9(14)12(2)3)11-17(15,16)8-5-10-13(4)6-8/h5-7,11H,1-4H3
InChIKeyONJSWXFUJGWOSI-UHFFFAOYSA-N
XLogP-0.82
TPSA84.30 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.32
LogP ≤ 5-0.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-2-[(1-methylpyrazol-4-yl)sulfonylamino]propanamide?
The IUPAC name of N,N-dimethyl-2-[(1-methylpyrazol-4-yl)sulfonylamino]propanamide (CID 47034944) is N,N-dimethyl-2-[(1-methylpyrazol-4-yl)sulfonylamino]propanamide.
What is the SMILES notation for N,N-dimethyl-2-[(1-methylpyrazol-4-yl)sulfonylamino]propanamide?
The canonical SMILES for N,N-dimethyl-2-[(1-methylpyrazol-4-yl)sulfonylamino]propanamide is CC(NS(=O)(=O)c1cnn(C)c1)C(=O)N(C)C.
What is the InChIKey of N,N-dimethyl-2-[(1-methylpyrazol-4-yl)sulfonylamino]propanamide?
The InChIKey is ONJSWXFUJGWOSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N4O3S/c1-7(9(14)12(2)3)11-17(15,16)8-5-10-13(4)6-8/h5-7,11H,1-4H3.
What are the key properties of N,N-dimethyl-2-[(1-methylpyrazol-4-yl)sulfonylamino]propanamide?
N,N-dimethyl-2-[(1-methylpyrazol-4-yl)sulfonylamino]propanamide has a molecular weight of 260.32 g/mol, XLogP of -0.82, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-2-[(1-methylpyrazol-4-yl)sulfonylamino]propanamide is sourced from PubChem (CID 47034944), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).