(2-methoxy-2,5-dimethylhex-5-en-3-yl)hydrazine

C9H20N2O — CID 105245497

IUPAC(2-methoxy-2,5-dimethylhex-5-en-3-yl)hydrazine
SMILESC=C(C)CC(NN)C(C)(C)OC
InChIInChI=1S/C9H20N2O/c1-7(2)6-8(11-10)9(3,4)12-5/h8,11H,1,6,10H2,2-5H3
InChIKeyCDRWMSCPSQIPBL-UHFFFAOYSA-N
MW172.27 g/mol
LogP1.21
Rot. Bonds5

About (2-methoxy-2,5-dimethylhex-5-en-3-yl)hydrazine

(2-methoxy-2,5-dimethylhex-5-en-3-yl)hydrazine (PubChem CID 105245497) has the molecular formula C9H20N2O and a molecular weight of 172.27 g/mol. Its IUPAC name is (2-methoxy-2,5-dimethylhex-5-en-3-yl)hydrazine.

Molecular Properties

Compound Name(2-methoxy-2,5-dimethylhex-5-en-3-yl)hydrazine
PubChem CID105245497
Molecular FormulaC9H20N2O
Molecular Weight172.27 g/mol
Exact Mass172.16
IUPAC Name(2-methoxy-2,5-dimethylhex-5-en-3-yl)hydrazine
SMILESC=C(C)CC(NN)C(C)(C)OC
InChIInChI=1S/C9H20N2O/c1-7(2)6-8(11-10)9(3,4)12-5/h8,11H,1,6,10H2,2-5H3
InChIKeyCDRWMSCPSQIPBL-UHFFFAOYSA-N
XLogP1.21
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
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

2-Methoxy-2,5-dimethylhex-5-en-3-amine
CID 79197651
(6-Methoxy-6-methylhept-1-en-4-yl)hydrazine
CID 103025210
(2-Methoxy-2-methyloct-7-en-4-yl)hydrazine
CID 103025340
(6-Methoxy-2,6-dimethylhept-1-en-4-yl)hydrazine
CID 103025386
(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
(1-Methoxy-5-methylhex-5-en-2-yl)hydrazine
CID 105207207
(1-Methoxy-4-methylpent-4-en-2-yl)hydrazine
CID 105207348
(1-Methoxy-4-methylidenehexan-2-yl)hydrazine
CID 105207356
(5-Methyl-1-propoxyhex-5-en-2-yl)hydrazine
CID 105209990
(4-Methyl-1-propoxypent-4-en-2-yl)hydrazine
CID 105210124

Frequently Asked Questions

What is the IUPAC name of (2-methoxy-2,5-dimethylhex-5-en-3-yl)hydrazine?
The IUPAC name of (2-methoxy-2,5-dimethylhex-5-en-3-yl)hydrazine (CID 105245497) is (2-methoxy-2,5-dimethylhex-5-en-3-yl)hydrazine.
What is the SMILES notation for (2-methoxy-2,5-dimethylhex-5-en-3-yl)hydrazine?
The canonical SMILES for (2-methoxy-2,5-dimethylhex-5-en-3-yl)hydrazine is C=C(C)CC(NN)C(C)(C)OC.
What is the InChIKey of (2-methoxy-2,5-dimethylhex-5-en-3-yl)hydrazine?
The InChIKey is CDRWMSCPSQIPBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20N2O/c1-7(2)6-8(11-10)9(3,4)12-5/h8,11H,1,6,10H2,2-5H3.
What are the key properties of (2-methoxy-2,5-dimethylhex-5-en-3-yl)hydrazine?
(2-methoxy-2,5-dimethylhex-5-en-3-yl)hydrazine has a molecular weight of 172.27 g/mol, XLogP of 1.21, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2-methoxy-2,5-dimethylhex-5-en-3-yl)hydrazine is sourced from PubChem (CID 105245497), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).