(2R)-N-(1H-pyrazol-5-yl)-2-(thiophen-2-ylsulfonylamino)propanamide

C10H12N4O3S2 — CID 95280952

IUPAC(2R)-N-(1H-pyrazol-5-yl)-2-(thiophen-2-ylsulfonylamino)propanamide
SMILESC[C@@H](NS(=O)(=O)c1cccs1)C(=O)Nc1ccn[nH]1
InChIInChI=1S/C10H12N4O3S2/c1-7(10(15)12-8-4-5-11-13-8)14-19(16,17)9-3-2-6-18-9/h2-7,14H,1H3,(H2,11,12,13,15)/t7-/m1/s1
InChIKeyIWXLKAYKFTYBNJ-SSDOTTSWSA-N
MW300.37 g/mol
LogP0.78
Rot. Bonds5

About (2R)-N-(1H-pyrazol-5-yl)-2-(thiophen-2-ylsulfonylamino)propanamide

(2R)-N-(1H-pyrazol-5-yl)-2-(thiophen-2-ylsulfonylamino)propanamide (PubChem CID 95280952) has the molecular formula C10H12N4O3S2 and a molecular weight of 300.37 g/mol. Its IUPAC name is (2R)-N-(1H-pyrazol-5-yl)-2-(thiophen-2-ylsulfonylamino)propanamide.

Molecular Properties

Compound Name(2R)-N-(1H-pyrazol-5-yl)-2-(thiophen-2-ylsulfonylamino)propanamide
PubChem CID95280952
Molecular FormulaC10H12N4O3S2
Molecular Weight300.37 g/mol
Exact Mass300.04
IUPAC Name(2R)-N-(1H-pyrazol-5-yl)-2-(thiophen-2-ylsulfonylamino)propanamide
SMILESC[C@@H](NS(=O)(=O)c1cccs1)C(=O)Nc1ccn[nH]1
InChIInChI=1S/C10H12N4O3S2/c1-7(10(15)12-8-4-5-11-13-8)14-19(16,17)9-3-2-6-18-9/h2-7,14H,1H3,(H2,11,12,13,15)/t7-/m1/s1
InChIKeyIWXLKAYKFTYBNJ-SSDOTTSWSA-N
XLogP0.78
TPSA103.95 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.37
LogP ≤ 50.78
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

N-(2-fluorophenyl)-2-(thiophen-2-ylsulfonylamino)propanamide
CID 110601235
N-(1-methylpyrazol-3-yl)-2-(thiophen-2-ylsulfonylamino)propanamide
CID 47321746
N-propyl-2-(thiophen-2-ylsulfonylamino)propanamide
CID 46820888
N-[4-(pyrazol-1-ylmethyl)phenyl]-2-(thiophen-2-ylsulfonylamino)propanamide
CID 55970450
N-(3-iodophenyl)-2-(thiophen-2-ylsulfonylamino)propanamide
CID 55645413
N-piperidin-4-yl-2-(thiophen-2-ylsulfonylamino)propanamide
CID 119387925
2,2-dimethyl-N-[3-[2-(thiophen-2-ylsulfonylamino)propanoylamino]phenyl]propanamide
CID 55909819
N,2-dimethyl-3-[2-(thiophen-2-ylsulfonylamino)propanoylamino]benzamide
CID 48529738
2-methyl-2-[2-(thiophen-2-ylsulfonylamino)propanoylamino]butanoic acid
CID 119199790
N-[(4-hydroxypyrrolidin-3-yl)methyl]-2-(thiophen-2-ylsulfonylamino)propanamide
CID 120944970
4-[2-(thiophen-2-ylsulfonylamino)propanoylamino]cyclohexane-1-carboxylic acid
CID 119230364
N-[(1S)-2-oxo-1-phenyl-2-(1H-pyrazol-5-ylamino)ethyl]thiophene-2-carboxamide
CID 95331365

Frequently Asked Questions

What is the IUPAC name of (2R)-N-(1H-pyrazol-5-yl)-2-(thiophen-2-ylsulfonylamino)propanamide?
The IUPAC name of (2R)-N-(1H-pyrazol-5-yl)-2-(thiophen-2-ylsulfonylamino)propanamide (CID 95280952) is (2R)-N-(1H-pyrazol-5-yl)-2-(thiophen-2-ylsulfonylamino)propanamide.
What is the SMILES notation for (2R)-N-(1H-pyrazol-5-yl)-2-(thiophen-2-ylsulfonylamino)propanamide?
The canonical SMILES for (2R)-N-(1H-pyrazol-5-yl)-2-(thiophen-2-ylsulfonylamino)propanamide is C[C@@H](NS(=O)(=O)c1cccs1)C(=O)Nc1ccn[nH]1.
What is the InChIKey of (2R)-N-(1H-pyrazol-5-yl)-2-(thiophen-2-ylsulfonylamino)propanamide?
The InChIKey is IWXLKAYKFTYBNJ-SSDOTTSWSA-N. The full InChI is InChI=1S/C10H12N4O3S2/c1-7(10(15)12-8-4-5-11-13-8)14-19(16,17)9-3-2-6-18-9/h2-7,14H,1H3,(H2,11,12,13,15)/t7-/m1/s1.
What are the key properties of (2R)-N-(1H-pyrazol-5-yl)-2-(thiophen-2-ylsulfonylamino)propanamide?
(2R)-N-(1H-pyrazol-5-yl)-2-(thiophen-2-ylsulfonylamino)propanamide has a molecular weight of 300.37 g/mol, XLogP of 0.78, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-(1H-pyrazol-5-yl)-2-(thiophen-2-ylsulfonylamino)propanamide is sourced from PubChem (CID 95280952), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).