(6-methoxy-6-methylhept-1-en-4-yl)hydrazine

C9H20N2O — CID 103025210

IUPAC(6-methoxy-6-methylhept-1-en-4-yl)hydrazine
SMILESC=CCC(CC(C)(C)OC)NN
InChIInChI=1S/C9H20N2O/c1-5-6-8(11-10)7-9(2,3)12-4/h5,8,11H,1,6-7,10H2,2-4H3
InChIKeyYRPCIDLQSUAEQJ-UHFFFAOYSA-N
MW172.27 g/mol
LogP1.21
Rot. Bonds6

About (6-methoxy-6-methylhept-1-en-4-yl)hydrazine

(6-methoxy-6-methylhept-1-en-4-yl)hydrazine (PubChem CID 103025210) has the molecular formula C9H20N2O and a molecular weight of 172.27 g/mol. Its IUPAC name is (6-methoxy-6-methylhept-1-en-4-yl)hydrazine.

Molecular Properties

Compound Name(6-methoxy-6-methylhept-1-en-4-yl)hydrazine
PubChem CID103025210
Molecular FormulaC9H20N2O
Molecular Weight172.27 g/mol
Exact Mass172.16
IUPAC Name(6-methoxy-6-methylhept-1-en-4-yl)hydrazine
SMILESC=CCC(CC(C)(C)OC)NN
InChIInChI=1S/C9H20N2O/c1-5-6-8(11-10)7-9(2,3)12-4/h5,8,11H,1,6-7,10H2,2-4H3
InChIKeyYRPCIDLQSUAEQJ-UHFFFAOYSA-N
XLogP1.21
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.27
LogP ≤ 51.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

6-Methoxy-6-methylhept-1-en-4-amine
CID 103024962
(2-Methoxy-2-methylnon-8-en-4-yl)hydrazine
CID 103025339
(2-Methoxy-2-methyloct-7-en-4-yl)hydrazine
CID 103025340
(5-Methoxy-5-methylhex-1-en-3-yl)hydrazine
CID 103025379
(6-Methoxy-2,6-dimethylhept-1-en-4-yl)hydrazine
CID 103025386
(6-Methoxy-2,6-dimethylhept-2-en-4-yl)hydrazine
CID 103025387
(5-Methoxy-2,5-dimethylhex-1-en-3-yl)hydrazine
CID 103025388
(2-Methoxy-2-methyl-6-methylideneoctan-4-yl)hydrazine
CID 103025389
(2-Methoxy-2,7-dimethyloct-7-en-4-yl)hydrazine
CID 103025484
(7-Methoxy-7-methyloct-1-en-4-yl)hydrazine
CID 103027061
1-(1-Methoxycyclobutyl)pent-4-en-2-ylhydrazine
CID 103560356
1-(1-Methoxycyclobutyl)hept-6-en-2-ylhydrazine
CID 103560471

Frequently Asked Questions

What is the IUPAC name of (6-methoxy-6-methylhept-1-en-4-yl)hydrazine?
The IUPAC name of (6-methoxy-6-methylhept-1-en-4-yl)hydrazine (CID 103025210) is (6-methoxy-6-methylhept-1-en-4-yl)hydrazine.
What is the SMILES notation for (6-methoxy-6-methylhept-1-en-4-yl)hydrazine?
The canonical SMILES for (6-methoxy-6-methylhept-1-en-4-yl)hydrazine is C=CCC(CC(C)(C)OC)NN.
What is the InChIKey of (6-methoxy-6-methylhept-1-en-4-yl)hydrazine?
The InChIKey is YRPCIDLQSUAEQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20N2O/c1-5-6-8(11-10)7-9(2,3)12-4/h5,8,11H,1,6-7,10H2,2-4H3.
What are the key properties of (6-methoxy-6-methylhept-1-en-4-yl)hydrazine?
(6-methoxy-6-methylhept-1-en-4-yl)hydrazine has a molecular weight of 172.27 g/mol, XLogP of 1.21, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (6-methoxy-6-methylhept-1-en-4-yl)hydrazine is sourced from PubChem (CID 103025210), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).