2-hydrazinyl-N-(4-methoxybutan-2-yl)pyrimidine-5-sulfonamide

C9H17N5O3S — CID 64605702

IUPAC2-hydrazinyl-N-(4-methoxybutan-2-yl)pyrimidine-5-sulfonamide
SMILESCOCCC(C)NS(=O)(=O)c1cnc(NN)nc1
InChIInChI=1S/C9H17N5O3S/c1-7(3-4-17-2)14-18(15,16)8-5-11-9(13-10)12-6-8/h5-7,14H,3-4,10H2,1-2H3,(H,11,12,13)
InChIKeySKPYIQGHJWOMEO-UHFFFAOYSA-N
MW275.33 g/mol
LogP-0.53
Rot. Bonds7

About 2-hydrazinyl-N-(4-methoxybutan-2-yl)pyrimidine-5-sulfonamide

2-hydrazinyl-N-(4-methoxybutan-2-yl)pyrimidine-5-sulfonamide (PubChem CID 64605702) has the molecular formula C9H17N5O3S and a molecular weight of 275.33 g/mol. Its IUPAC name is 2-hydrazinyl-N-(4-methoxybutan-2-yl)pyrimidine-5-sulfonamide.

Molecular Properties

Compound Name2-hydrazinyl-N-(4-methoxybutan-2-yl)pyrimidine-5-sulfonamide
PubChem CID64605702
Molecular FormulaC9H17N5O3S
Molecular Weight275.33 g/mol
Exact Mass275.11
IUPAC Name2-hydrazinyl-N-(4-methoxybutan-2-yl)pyrimidine-5-sulfonamide
SMILESCOCCC(C)NS(=O)(=O)c1cnc(NN)nc1
InChIInChI=1S/C9H17N5O3S/c1-7(3-4-17-2)14-18(15,16)8-5-11-9(13-10)12-6-8/h5-7,14H,3-4,10H2,1-2H3,(H,11,12,13)
InChIKeySKPYIQGHJWOMEO-UHFFFAOYSA-N
XLogP-0.53
TPSA119.23 Ų
H-Bond Donors3
H-Bond Acceptors7
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.33
LogP ≤ 5-0.53
H-Bond Donors ≤ 53
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

2-hydrazinyl-N-(4-methylpentan-2-yl)pyrimidine-5-sulfonamide
CID 61327171
6-amino-N-(4-methoxybutan-2-yl)pyridine-3-sulfonamide
CID 64602408
2-hydrazinyl-N-(4-methoxybutan-2-yl)pyridine-4-sulfonamide
CID 64605294
3-hydrazinyl-N-(4-methoxybutan-2-yl)pyridine-2-sulfonamide
CID 103301657
2-chloro-N-(1-methoxypropan-2-yl)pyrimidine-5-sulfonamide
CID 43456403
2-hydrazinyl-N-(1-thiophen-2-ylpropan-2-yl)pyrimidine-5-sulfonamide
CID 63292014
2-hydrazinyl-N-(4-methoxybutan-2-yl)benzenesulfonamide
CID 64605089
2-hydrazinyl-N-(4-methylpentyl)pyrimidine-5-sulfonamide
CID 63004596
2-hydrazinyl-N-(1-phenylethyl)pyrimidine-5-sulfonamide
CID 61328714
4-hydrazinyl-N-(4-methoxybutan-2-yl)-3-nitrobenzenesulfonamide
CID 64605293
4-amino-3-bromo-N-(4-methoxybutan-2-yl)benzenesulfonamide
CID 64601232
2-chloro-N-(4-methoxybutan-2-yl)-1,3-thiazole-5-sulfonamide
CID 64603615

Frequently Asked Questions

What is the IUPAC name of 2-hydrazinyl-N-(4-methoxybutan-2-yl)pyrimidine-5-sulfonamide?
The IUPAC name of 2-hydrazinyl-N-(4-methoxybutan-2-yl)pyrimidine-5-sulfonamide (CID 64605702) is 2-hydrazinyl-N-(4-methoxybutan-2-yl)pyrimidine-5-sulfonamide.
What is the SMILES notation for 2-hydrazinyl-N-(4-methoxybutan-2-yl)pyrimidine-5-sulfonamide?
The canonical SMILES for 2-hydrazinyl-N-(4-methoxybutan-2-yl)pyrimidine-5-sulfonamide is COCCC(C)NS(=O)(=O)c1cnc(NN)nc1.
What is the InChIKey of 2-hydrazinyl-N-(4-methoxybutan-2-yl)pyrimidine-5-sulfonamide?
The InChIKey is SKPYIQGHJWOMEO-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17N5O3S/c1-7(3-4-17-2)14-18(15,16)8-5-11-9(13-10)12-6-8/h5-7,14H,3-4,10H2,1-2H3,(H,11,12,13).
What are the key properties of 2-hydrazinyl-N-(4-methoxybutan-2-yl)pyrimidine-5-sulfonamide?
2-hydrazinyl-N-(4-methoxybutan-2-yl)pyrimidine-5-sulfonamide has a molecular weight of 275.33 g/mol, XLogP of -0.53, 7 rotatable bonds, 3 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydrazinyl-N-(4-methoxybutan-2-yl)pyrimidine-5-sulfonamide is sourced from PubChem (CID 64605702), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).