N,N-diethyl-3-hydrazinyloct-7-en-1-amine

C12H27N3 — CID 105243962

IUPACN,N-diethyl-3-hydrazinyloct-7-en-1-amine
SMILESC=CCCCC(CCN(CC)CC)NN
InChIInChI=1S/C12H27N3/c1-4-7-8-9-12(14-13)10-11-15(5-2)6-3/h4,12,14H,1,5-11,13H2,2-3H3
InChIKeyHFGBVHFUXWYYBR-UHFFFAOYSA-N
MW213.37 g/mol
LogP1.91
Rot. Bonds10

About N,N-diethyl-3-hydrazinyloct-7-en-1-amine

N,N-diethyl-3-hydrazinyloct-7-en-1-amine (PubChem CID 105243962) has the molecular formula C12H27N3 and a molecular weight of 213.37 g/mol. Its IUPAC name is N,N-diethyl-3-hydrazinyloct-7-en-1-amine.

Molecular Properties

Compound NameN,N-diethyl-3-hydrazinyloct-7-en-1-amine
PubChem CID105243962
Molecular FormulaC12H27N3
Molecular Weight213.37 g/mol
Exact Mass213.22
IUPAC NameN,N-diethyl-3-hydrazinyloct-7-en-1-amine
SMILESC=CCCCC(CCN(CC)CC)NN
InChIInChI=1S/C12H27N3/c1-4-7-8-9-12(14-13)10-11-15(5-2)6-3/h4,12,14H,1,5-11,13H2,2-3H3
InChIKeyHFGBVHFUXWYYBR-UHFFFAOYSA-N
XLogP1.91
TPSA41.29 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds10
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.37
LogP ≤ 51.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'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

1,4-Bis(prop-2-enyl)triazonane
CID 70313807
Oct-1-en-4-ylhydrazine
CID 87148365
Oct-1-en-3-ylhydrazine
CID 88379535
N'-(4-hydrazinylhex-5-enyl)propane-1,3-diamine
CID 138564639
N-amino-N-(oct-7-en-3-ylamino)methanamine
CID 146488157
(2S)-1-N-methyl-2-prop-2-enylpiperidine-1,4-diamine
CID 173973543
2-Hept-1-en-3-yl-1,1-dimethylhydrazine
CID 175533095
1,1-Dimethyl-2-non-1-en-4-ylhydrazine
CID 21597521
1-N,1-N-diethyloct-7-ene-1,3-diamine
CID 79086927
1-N,1-N-diethylhept-6-ene-1,3-diamine
CID 79087514
1-N,1-N-diethyl-3-N-methyloct-7-ene-1,3-diamine
CID 79087532
1-N,1-N,3-N-triethyloct-7-ene-1,3-diamine
CID 79087638

Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-3-hydrazinyloct-7-en-1-amine?
The IUPAC name of N,N-diethyl-3-hydrazinyloct-7-en-1-amine (CID 105243962) is N,N-diethyl-3-hydrazinyloct-7-en-1-amine.
What is the SMILES notation for N,N-diethyl-3-hydrazinyloct-7-en-1-amine?
The canonical SMILES for N,N-diethyl-3-hydrazinyloct-7-en-1-amine is C=CCCCC(CCN(CC)CC)NN.
What is the InChIKey of N,N-diethyl-3-hydrazinyloct-7-en-1-amine?
The InChIKey is HFGBVHFUXWYYBR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H27N3/c1-4-7-8-9-12(14-13)10-11-15(5-2)6-3/h4,12,14H,1,5-11,13H2,2-3H3.
What are the key properties of N,N-diethyl-3-hydrazinyloct-7-en-1-amine?
N,N-diethyl-3-hydrazinyloct-7-en-1-amine has a molecular weight of 213.37 g/mol, XLogP of 1.91, 10 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-3-hydrazinyloct-7-en-1-amine is sourced from PubChem (CID 105243962), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).