(1-methoxy-2-methyl-7-methylsulfonylheptan-4-yl)hydrazine

C10H24N2O3S — CID 105290999

IUPAC(1-methoxy-2-methyl-7-methylsulfonylheptan-4-yl)hydrazine
SMILESCOCC(C)CC(CCCS(C)(=O)=O)NN
InChIInChI=1S/C10H24N2O3S/c1-9(8-15-2)7-10(12-11)5-4-6-16(3,13)14/h9-10,12H,4-8,11H2,1-3H3
InChIKeyMPFKHSWYTMQGSX-UHFFFAOYSA-N
MW252.38 g/mol
LogP0.32
Rot. Bonds9

About (1-methoxy-2-methyl-7-methylsulfonylheptan-4-yl)hydrazine

(1-methoxy-2-methyl-7-methylsulfonylheptan-4-yl)hydrazine (PubChem CID 105290999) has the molecular formula C10H24N2O3S and a molecular weight of 252.38 g/mol. Its IUPAC name is (1-methoxy-2-methyl-7-methylsulfonylheptan-4-yl)hydrazine.

Molecular Properties

Compound Name(1-methoxy-2-methyl-7-methylsulfonylheptan-4-yl)hydrazine
PubChem CID105290999
Molecular FormulaC10H24N2O3S
Molecular Weight252.38 g/mol
Exact Mass252.15
IUPAC Name(1-methoxy-2-methyl-7-methylsulfonylheptan-4-yl)hydrazine
SMILESCOCC(C)CC(CCCS(C)(=O)=O)NN
InChIInChI=1S/C10H24N2O3S/c1-9(8-15-2)7-10(12-11)5-4-6-16(3,13)14/h9-10,12H,4-8,11H2,1-3H3
InChIKeyMPFKHSWYTMQGSX-UHFFFAOYSA-N
XLogP0.32
TPSA81.42 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.38
LogP ≤ 50.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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

(5-methoxy-1-methylsulfonylhexan-3-yl)hydrazine
CID 114984912
(1-methoxy-5-methylsulfonylpentan-3-yl)hydrazine
CID 114984584
(1,1,1-trifluoro-7-methylsulfonylheptan-4-yl)hydrazine
CID 105248920
(1-butan-2-ylsulfanyl-5-methylsulfonylpentan-2-yl)hydrazine
CID 105227073
N,N-diethyl-3-hydrazinyl-6-methylsulfonylhexan-1-amine
CID 105243995
N,4-dimethyl-7-methylsulfonylheptan-2-amine
CID 64721410
[1-(2-methoxyphenyl)-5-methylsulfonylpentan-2-yl]hydrazine
CID 105204960
N-ethyl-6,8,8-trimethyl-1-methylsulfonylnonan-4-amine
CID 115820792
(1,1-difluoro-5-methylsulfonylpentan-2-yl)hydrazine
CID 105265023
(5-ethoxy-5-ethyl-1-methylsulfonylheptan-4-yl)hydrazine
CID 105275021
(1,1,1-trifluoro-5-methylsulfonylpentan-2-yl)hydrazine
CID 105215617
2-bromo-1-methoxy-6-methylsulfonylhexane
CID 63195962

Frequently Asked Questions

What is the IUPAC name of (1-methoxy-2-methyl-7-methylsulfonylheptan-4-yl)hydrazine?
The IUPAC name of (1-methoxy-2-methyl-7-methylsulfonylheptan-4-yl)hydrazine (CID 105290999) is (1-methoxy-2-methyl-7-methylsulfonylheptan-4-yl)hydrazine.
What is the SMILES notation for (1-methoxy-2-methyl-7-methylsulfonylheptan-4-yl)hydrazine?
The canonical SMILES for (1-methoxy-2-methyl-7-methylsulfonylheptan-4-yl)hydrazine is COCC(C)CC(CCCS(C)(=O)=O)NN.
What is the InChIKey of (1-methoxy-2-methyl-7-methylsulfonylheptan-4-yl)hydrazine?
The InChIKey is MPFKHSWYTMQGSX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H24N2O3S/c1-9(8-15-2)7-10(12-11)5-4-6-16(3,13)14/h9-10,12H,4-8,11H2,1-3H3.
What are the key properties of (1-methoxy-2-methyl-7-methylsulfonylheptan-4-yl)hydrazine?
(1-methoxy-2-methyl-7-methylsulfonylheptan-4-yl)hydrazine has a molecular weight of 252.38 g/mol, XLogP of 0.32, 9 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (1-methoxy-2-methyl-7-methylsulfonylheptan-4-yl)hydrazine is sourced from PubChem (CID 105290999), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).