[2-(2-methylmorpholin-4-yl)sulfonyl-5-nitrophenyl]hydrazine

C11H16N4O5S — CID 43142206

IUPAC[2-(2-methylmorpholin-4-yl)sulfonyl-5-nitrophenyl]hydrazine
SMILESCC1CN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2NN)CCO1
InChIInChI=1S/C11H16N4O5S/c1-8-7-14(4-5-20-8)21(18,19)11-3-2-9(15(16)17)6-10(11)13-12/h2-3,6,8,13H,4-5,7,12H2,1H3
InChIKeyVZGPAWNQCUNGRT-UHFFFAOYSA-N
MW316.34 g/mol
LogP0.29
Rot. Bonds4

About [2-(2-methylmorpholin-4-yl)sulfonyl-5-nitrophenyl]hydrazine

[2-(2-methylmorpholin-4-yl)sulfonyl-5-nitrophenyl]hydrazine (PubChem CID 43142206) has the molecular formula C11H16N4O5S and a molecular weight of 316.34 g/mol. Its IUPAC name is [2-(2-methylmorpholin-4-yl)sulfonyl-5-nitrophenyl]hydrazine.

Molecular Properties

Compound Name[2-(2-methylmorpholin-4-yl)sulfonyl-5-nitrophenyl]hydrazine
PubChem CID43142206
Molecular FormulaC11H16N4O5S
Molecular Weight316.34 g/mol
Exact Mass316.08
IUPAC Name[2-(2-methylmorpholin-4-yl)sulfonyl-5-nitrophenyl]hydrazine
SMILESCC1CN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2NN)CCO1
InChIInChI=1S/C11H16N4O5S/c1-8-7-14(4-5-20-8)21(18,19)11-3-2-9(15(16)17)6-10(11)13-12/h2-3,6,8,13H,4-5,7,12H2,1H3
InChIKeyVZGPAWNQCUNGRT-UHFFFAOYSA-N
XLogP0.29
TPSA127.80 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.34
LogP ≤ 50.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

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

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Related Compounds

N-methyl-2-(2-methylmorpholin-4-yl)sulfonyl-5-nitroaniline
CID 62150394
2-methyl-4-(2-methyl-5-nitrophenyl)sulfonylmorpholine
CID 51294925
[2-(3-methylpiperidin-1-yl)sulfonyl-5-nitrophenyl]hydrazine
CID 43142204
4-(2-chloro-5-nitrophenyl)sulfonyl-2-methylmorpholine
CID 43394184
4-(2-methylmorpholin-4-yl)sulfonyl-2-nitroaniline
CID 43348538
2-hydrazinyl-N-morpholin-4-yl-4-nitrobenzenesulfonamide
CID 83018414
4-(2,4-dimethylphenyl)sulfonyl-2-methylmorpholine
CID 51294935
5-bromo-2-(2-methylmorpholin-4-yl)sulfonylaniline
CID 43257108
2-hydrazinyl-N-methyl-4-nitrobenzenesulfonamide
CID 43142196
N-ethyl-2-[(2-methylmorpholin-4-yl)methyl]-4-nitroaniline
CID 62184256
(2S,6S)-2,6-dimethyl-4-(2-methyl-5-nitrophenyl)sulfonylmorpholine
CID 7510206
2-hydrazinyl-N,N-dimethyl-4-nitrobenzenesulfonamide
CID 43142166

Frequently Asked Questions

What is the IUPAC name of [2-(2-methylmorpholin-4-yl)sulfonyl-5-nitrophenyl]hydrazine?
The IUPAC name of [2-(2-methylmorpholin-4-yl)sulfonyl-5-nitrophenyl]hydrazine (CID 43142206) is [2-(2-methylmorpholin-4-yl)sulfonyl-5-nitrophenyl]hydrazine.
What is the SMILES notation for [2-(2-methylmorpholin-4-yl)sulfonyl-5-nitrophenyl]hydrazine?
The canonical SMILES for [2-(2-methylmorpholin-4-yl)sulfonyl-5-nitrophenyl]hydrazine is CC1CN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2NN)CCO1.
What is the InChIKey of [2-(2-methylmorpholin-4-yl)sulfonyl-5-nitrophenyl]hydrazine?
The InChIKey is VZGPAWNQCUNGRT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N4O5S/c1-8-7-14(4-5-20-8)21(18,19)11-3-2-9(15(16)17)6-10(11)13-12/h2-3,6,8,13H,4-5,7,12H2,1H3.
What are the key properties of [2-(2-methylmorpholin-4-yl)sulfonyl-5-nitrophenyl]hydrazine?
[2-(2-methylmorpholin-4-yl)sulfonyl-5-nitrophenyl]hydrazine has a molecular weight of 316.34 g/mol, XLogP of 0.29, 4 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(2-methylmorpholin-4-yl)sulfonyl-5-nitrophenyl]hydrazine is sourced from PubChem (CID 43142206), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).