N,N-diethyl-3-hydrazinyl-2-methyloct-7-en-2-amine

C13H29N3 — CID 105239197

IUPACN,N-diethyl-3-hydrazinyl-2-methyloct-7-en-2-amine
SMILESC=CCCCC(NN)C(C)(C)N(CC)CC
InChIInChI=1S/C13H29N3/c1-6-9-10-11-12(15-14)13(4,5)16(7-2)8-3/h6,12,15H,1,7-11,14H2,2-5H3
InChIKeyHHYJKGNMFNTBED-UHFFFAOYSA-N
MW227.40 g/mol
LogP2.30
Rot. Bonds9

About N,N-diethyl-3-hydrazinyl-2-methyloct-7-en-2-amine

N,N-diethyl-3-hydrazinyl-2-methyloct-7-en-2-amine (PubChem CID 105239197) has the molecular formula C13H29N3 and a molecular weight of 227.40 g/mol. Its IUPAC name is N,N-diethyl-3-hydrazinyl-2-methyloct-7-en-2-amine.

Molecular Properties

Compound NameN,N-diethyl-3-hydrazinyl-2-methyloct-7-en-2-amine
PubChem CID105239197
Molecular FormulaC13H29N3
Molecular Weight227.40 g/mol
Exact Mass227.24
IUPAC NameN,N-diethyl-3-hydrazinyl-2-methyloct-7-en-2-amine
SMILESC=CCCCC(NN)C(C)(C)N(CC)CC
InChIInChI=1S/C13H29N3/c1-6-9-10-11-12(15-14)13(4,5)16(7-2)8-3/h6,12,15H,1,7-11,14H2,2-5H3
InChIKeyHHYJKGNMFNTBED-UHFFFAOYSA-N
XLogP2.30
TPSA41.29 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.40
LogP ≤ 52.30
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

2-N,2-N,2-trimethyloct-7-ene-2,3-diamine
CID 79053191
2-N,2-N,2-trimethyl-3-N-propyloct-7-ene-2,3-diamine
CID 79053640
2-N,2-N-diethyl-2-methyloct-7-ene-2,3-diamine
CID 79053974
3-N-ethyl-2-N,2-N,2-trimethyloct-7-ene-2,3-diamine
CID 79054114
2-N,2-N-diethyl-2-methylhept-6-ene-2,3-diamine
CID 79054256
2-N,2-N,3-N,2-tetramethyloct-7-ene-2,3-diamine
CID 79054295
2-N,2-N,3-N-triethyl-2-methyloct-7-ene-2,3-diamine
CID 79055678
2-N,2-N-diethyl-3-N,2-dimethyloct-7-ene-2,3-diamine
CID 79056411
3-N,3-N,3-triethyloct-7-ene-3,4-diamine
CID 79067403
3-N,3-N-diethyl-3-methyloct-7-ene-3,4-diamine
CID 79069138
3-N,3-N-diethyl-3-methylnon-8-ene-3,4-diamine
CID 79069218
3-hydrazinyl-N,N,2-trimethyloct-7-en-2-amine
CID 105238851

Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-3-hydrazinyl-2-methyloct-7-en-2-amine?
The IUPAC name of N,N-diethyl-3-hydrazinyl-2-methyloct-7-en-2-amine (CID 105239197) is N,N-diethyl-3-hydrazinyl-2-methyloct-7-en-2-amine.
What is the SMILES notation for N,N-diethyl-3-hydrazinyl-2-methyloct-7-en-2-amine?
The canonical SMILES for N,N-diethyl-3-hydrazinyl-2-methyloct-7-en-2-amine is C=CCCCC(NN)C(C)(C)N(CC)CC.
What is the InChIKey of N,N-diethyl-3-hydrazinyl-2-methyloct-7-en-2-amine?
The InChIKey is HHYJKGNMFNTBED-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H29N3/c1-6-9-10-11-12(15-14)13(4,5)16(7-2)8-3/h6,12,15H,1,7-11,14H2,2-5H3.
What are the key properties of N,N-diethyl-3-hydrazinyl-2-methyloct-7-en-2-amine?
N,N-diethyl-3-hydrazinyl-2-methyloct-7-en-2-amine has a molecular weight of 227.40 g/mol, XLogP of 2.30, 9 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-3-hydrazinyl-2-methyloct-7-en-2-amine is sourced from PubChem (CID 105239197), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).