N,N-diethyl-3-hydrazinylpent-4-en-1-amine

C9H21N3 — CID 105243964

IUPACN,N-diethyl-3-hydrazinylpent-4-en-1-amine
SMILESC=CC(CCN(CC)CC)NN
InChIInChI=1S/C9H21N3/c1-4-9(11-10)7-8-12(5-2)6-3/h4,9,11H,1,5-8,10H2,2-3H3
InChIKeyWYXRYXOFKMWVHY-UHFFFAOYSA-N
MW171.29 g/mol
LogP0.74
Rot. Bonds7

About N,N-diethyl-3-hydrazinylpent-4-en-1-amine

N,N-diethyl-3-hydrazinylpent-4-en-1-amine (PubChem CID 105243964) has the molecular formula C9H21N3 and a molecular weight of 171.29 g/mol. Its IUPAC name is N,N-diethyl-3-hydrazinylpent-4-en-1-amine.

Molecular Properties

Compound NameN,N-diethyl-3-hydrazinylpent-4-en-1-amine
PubChem CID105243964
Molecular FormulaC9H21N3
Molecular Weight171.29 g/mol
Exact Mass171.17
IUPAC NameN,N-diethyl-3-hydrazinylpent-4-en-1-amine
SMILESC=CC(CCN(CC)CC)NN
InChIInChI=1S/C9H21N3/c1-4-9(11-10)7-8-12(5-2)6-3/h4,9,11H,1,5-8,10H2,2-3H3
InChIKeyWYXRYXOFKMWVHY-UHFFFAOYSA-N
XLogP0.74
TPSA41.29 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.29
LogP ≤ 50.74
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

1-N,1-N,3-N-triethyl-5-methylhex-4-ene-1,3-diamine
CID 79179939
N,N-diethyl-4-hydrazinylpentan-1-amine
CID 143055875
N,N-diethyl-2-hydrazinylethanamine
CID 3028735
N,N-diethyl-3-hydrazinyl-6-methylsulfonylhexan-1-amine
CID 105243995
1-N,1-N-diethyl-3-N-methylpentane-1,3-diamine
CID 79087133
N,N-diethyl-3-(furan-2-yl)-3-hydrazinylpropan-1-amine
CID 105243941
N,N-diethyl-3-hydrazinyl-4-(1-methylpyrazol-4-yl)butan-1-amine
CID 105244100
N,N-diethyl-2-hydrazinylpropan-1-amine
CID 55279029
5,7,7-trimethyloct-1-en-3-ylhydrazine
CID 105317975
N,N-diethyl-3-hydrazinyl-3-(2-methoxyphenyl)propan-1-amine
CID 105243936
N,N-diethyl-3-hydrazinyl-3-(2,3,4-trifluorophenyl)propan-1-amine
CID 105243943
N,N-diethyl-3-hydrazinyl-3-(3-methylphenyl)propan-1-amine
CID 105244054

Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-3-hydrazinylpent-4-en-1-amine?
The IUPAC name of N,N-diethyl-3-hydrazinylpent-4-en-1-amine (CID 105243964) is N,N-diethyl-3-hydrazinylpent-4-en-1-amine.
What is the SMILES notation for N,N-diethyl-3-hydrazinylpent-4-en-1-amine?
The canonical SMILES for N,N-diethyl-3-hydrazinylpent-4-en-1-amine is C=CC(CCN(CC)CC)NN.
What is the InChIKey of N,N-diethyl-3-hydrazinylpent-4-en-1-amine?
The InChIKey is WYXRYXOFKMWVHY-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H21N3/c1-4-9(11-10)7-8-12(5-2)6-3/h4,9,11H,1,5-8,10H2,2-3H3.
What are the key properties of N,N-diethyl-3-hydrazinylpent-4-en-1-amine?
N,N-diethyl-3-hydrazinylpent-4-en-1-amine has a molecular weight of 171.29 g/mol, XLogP of 0.74, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-3-hydrazinylpent-4-en-1-amine is sourced from PubChem (CID 105243964), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).