(2,5-dimethoxy-4-methylsulfonylphenyl)methylhydrazine

C10H16N2O4S — CID 116932374

IUPAC(2,5-dimethoxy-4-methylsulfonylphenyl)methylhydrazine
SMILESCOc1cc(S(C)(=O)=O)c(OC)cc1CNN
InChIInChI=1S/C10H16N2O4S/c1-15-8-5-10(17(3,13)14)9(16-2)4-7(8)6-12-11/h4-5,12H,6,11H2,1-3H3
InChIKeyRWMGQRUCKDPTSB-UHFFFAOYSA-N
MW260.31 g/mol
LogP0.07
Rot. Bonds5

About (2,5-dimethoxy-4-methylsulfonylphenyl)methylhydrazine

(2,5-dimethoxy-4-methylsulfonylphenyl)methylhydrazine (PubChem CID 116932374) has the molecular formula C10H16N2O4S and a molecular weight of 260.31 g/mol. Its IUPAC name is (2,5-dimethoxy-4-methylsulfonylphenyl)methylhydrazine.

Molecular Properties

Compound Name(2,5-dimethoxy-4-methylsulfonylphenyl)methylhydrazine
PubChem CID116932374
Molecular FormulaC10H16N2O4S
Molecular Weight260.31 g/mol
Exact Mass260.08
IUPAC Name(2,5-dimethoxy-4-methylsulfonylphenyl)methylhydrazine
SMILESCOc1cc(S(C)(=O)=O)c(OC)cc1CNN
InChIInChI=1S/C10H16N2O4S/c1-15-8-5-10(17(3,13)14)9(16-2)4-7(8)6-12-11/h4-5,12H,6,11H2,1-3H3
InChIKeyRWMGQRUCKDPTSB-UHFFFAOYSA-N
XLogP0.07
TPSA90.65 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.31
LogP ≤ 50.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

Analyze (2,5-dimethoxy-4-methylsulfonylphenyl)methylhydrazine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-(2,5-dimethoxy-4-methylsulfonylphenyl)-N-methylmethanamine
CID 116927354
4-(2,5-dimethoxy-4-methylsulfonylphenyl)butan-1-amine
CID 117463945
N-[(4,5-dimethoxy-2-methylsulfonylphenyl)methyl]hydroxylamine
CID 117407160
1-(isocyanatomethyl)-2,5-dimethoxy-4-methylsulfonylbenzene
CID 117430855
3-(4,5-dimethoxy-2-methylsulfonylphenyl)propan-1-amine
CID 117436174
N-[(5-methoxy-4-methyl-2-methylsulfonylphenyl)methyl]hydroxylamine
CID 117365232
amino-(2,5-dimethoxy-4-methylsulfonylphenyl)methanol
CID 116939710
(2,5-diethoxy-4-methylsulfonylphenyl)methylurea
CID 174787253
O-[2-(5-fluoro-2-methoxy-4-methylsulfonylphenyl)ethyl]hydroxylamine
CID 117412246
2-(5-fluoro-2-methoxy-4-methylsulfonylphenyl)acetic acid
CID 117409770
(2S)-1-(4-ethylsulfonyl-2,5-dimethoxyphenyl)propan-2-amine
CID 101190835
(2,5-difluoro-4-methoxyphenyl)methylhydrazine
CID 116932362

Frequently Asked Questions

What is the IUPAC name of (2,5-dimethoxy-4-methylsulfonylphenyl)methylhydrazine?
The IUPAC name of (2,5-dimethoxy-4-methylsulfonylphenyl)methylhydrazine (CID 116932374) is (2,5-dimethoxy-4-methylsulfonylphenyl)methylhydrazine.
What is the SMILES notation for (2,5-dimethoxy-4-methylsulfonylphenyl)methylhydrazine?
The canonical SMILES for (2,5-dimethoxy-4-methylsulfonylphenyl)methylhydrazine is COc1cc(S(C)(=O)=O)c(OC)cc1CNN.
What is the InChIKey of (2,5-dimethoxy-4-methylsulfonylphenyl)methylhydrazine?
The InChIKey is RWMGQRUCKDPTSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2O4S/c1-15-8-5-10(17(3,13)14)9(16-2)4-7(8)6-12-11/h4-5,12H,6,11H2,1-3H3.
What are the key properties of (2,5-dimethoxy-4-methylsulfonylphenyl)methylhydrazine?
(2,5-dimethoxy-4-methylsulfonylphenyl)methylhydrazine has a molecular weight of 260.31 g/mol, XLogP of 0.07, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (2,5-dimethoxy-4-methylsulfonylphenyl)methylhydrazine is sourced from PubChem (CID 116932374), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).