N-ethyl-2-hydrazinyl-N-(thiophen-2-ylmethyl)pyrimidine-5-sulfonamide

C11H15N5O2S2 — CID 61438022

IUPACN-ethyl-2-hydrazinyl-N-(thiophen-2-ylmethyl)pyrimidine-5-sulfonamide
SMILESCCN(Cc1cccs1)S(=O)(=O)c1cnc(NN)nc1
InChIInChI=1S/C11H15N5O2S2/c1-2-16(8-9-4-3-5-19-9)20(17,18)10-6-13-11(15-12)14-7-10/h3-7H,2,8,12H2,1H3,(H,13,14,15)
InChIKeyRWSVISYQNAEUKW-UHFFFAOYSA-N
MW313.41 g/mol
LogP1.03
Rot. Bonds6

About N-ethyl-2-hydrazinyl-N-(thiophen-2-ylmethyl)pyrimidine-5-sulfonamide

N-ethyl-2-hydrazinyl-N-(thiophen-2-ylmethyl)pyrimidine-5-sulfonamide (PubChem CID 61438022) has the molecular formula C11H15N5O2S2 and a molecular weight of 313.41 g/mol. Its IUPAC name is N-ethyl-2-hydrazinyl-N-(thiophen-2-ylmethyl)pyrimidine-5-sulfonamide.

Molecular Properties

Compound NameN-ethyl-2-hydrazinyl-N-(thiophen-2-ylmethyl)pyrimidine-5-sulfonamide
PubChem CID61438022
Molecular FormulaC11H15N5O2S2
Molecular Weight313.41 g/mol
Exact Mass313.07
IUPAC NameN-ethyl-2-hydrazinyl-N-(thiophen-2-ylmethyl)pyrimidine-5-sulfonamide
SMILESCCN(Cc1cccs1)S(=O)(=O)c1cnc(NN)nc1
InChIInChI=1S/C11H15N5O2S2/c1-2-16(8-9-4-3-5-19-9)20(17,18)10-6-13-11(15-12)14-7-10/h3-7H,2,8,12H2,1H3,(H,13,14,15)
InChIKeyRWSVISYQNAEUKW-UHFFFAOYSA-N
XLogP1.03
TPSA101.21 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.41
LogP ≤ 51.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

6-cyano-N-ethyl-N-(thiophen-2-ylmethyl)pyridine-3-sulfonamide
CID 115602484
4-N-ethyl-4-N-(thiophen-2-ylmethyl)benzene-1,4-disulfonamide
CID 26530442
N-ethyl-2-hydrazinyl-N-(thiophen-2-ylmethyl)benzenesulfonamide
CID 61437971
N-ethyl-4-(methylamino)-N-(thiophen-2-ylmethyl)benzenesulfonamide
CID 61437377
N-ethyl-4-hydroxy-N-(thiophen-2-ylmethyl)benzenesulfonamide
CID 61437625
4-cyano-N-ethyl-N-(thiophen-2-ylmethyl)benzenesulfonamide
CID 30171718
2-chloro-N-ethyl-N-(thiophen-2-ylmethyl)-1,3-thiazole-5-sulfonamide
CID 61042679
N-[4-[ethyl(thiophen-2-ylmethyl)sulfamoyl]phenyl]acetamide
CID 30171646
2-chloro-N-(2-methoxyethyl)-N-(thiophen-2-ylmethyl)pyrimidine-5-sulfonamide
CID 61040679
N-ethyl-N-(thiophen-2-ylmethyl)methanesulfonamide
CID 60681457
2-hydrazinyl-N-(1-thiophen-2-ylpropan-2-yl)pyrimidine-5-sulfonamide
CID 63292014
4-ethoxy-N,N-bis(thiophen-2-ylmethyl)benzenesulfonamide
CID 8801727

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-hydrazinyl-N-(thiophen-2-ylmethyl)pyrimidine-5-sulfonamide?
The IUPAC name of N-ethyl-2-hydrazinyl-N-(thiophen-2-ylmethyl)pyrimidine-5-sulfonamide (CID 61438022) is N-ethyl-2-hydrazinyl-N-(thiophen-2-ylmethyl)pyrimidine-5-sulfonamide.
What is the SMILES notation for N-ethyl-2-hydrazinyl-N-(thiophen-2-ylmethyl)pyrimidine-5-sulfonamide?
The canonical SMILES for N-ethyl-2-hydrazinyl-N-(thiophen-2-ylmethyl)pyrimidine-5-sulfonamide is CCN(Cc1cccs1)S(=O)(=O)c1cnc(NN)nc1.
What is the InChIKey of N-ethyl-2-hydrazinyl-N-(thiophen-2-ylmethyl)pyrimidine-5-sulfonamide?
The InChIKey is RWSVISYQNAEUKW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N5O2S2/c1-2-16(8-9-4-3-5-19-9)20(17,18)10-6-13-11(15-12)14-7-10/h3-7H,2,8,12H2,1H3,(H,13,14,15).
What are the key properties of N-ethyl-2-hydrazinyl-N-(thiophen-2-ylmethyl)pyrimidine-5-sulfonamide?
N-ethyl-2-hydrazinyl-N-(thiophen-2-ylmethyl)pyrimidine-5-sulfonamide has a molecular weight of 313.41 g/mol, XLogP of 1.03, 6 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-hydrazinyl-N-(thiophen-2-ylmethyl)pyrimidine-5-sulfonamide is sourced from PubChem (CID 61438022), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).