4-hydrazinyl-N,N,3-trimethylhept-6-yn-3-amine

C10H21N3 — CID 105240612

IUPAC4-hydrazinyl-N,N,3-trimethylhept-6-yn-3-amine
SMILESC#CCC(NN)C(C)(CC)N(C)C
InChIInChI=1S/C10H21N3/c1-6-8-9(12-11)10(3,7-2)13(4)5/h1,9,12H,7-8,11H2,2-5H3
InChIKeyVVVRGCYCJMNPQL-UHFFFAOYSA-N
MW183.30 g/mol
LogP0.57
Rot. Bonds5

About 4-hydrazinyl-N,N,3-trimethylhept-6-yn-3-amine

4-hydrazinyl-N,N,3-trimethylhept-6-yn-3-amine (PubChem CID 105240612) has the molecular formula C10H21N3 and a molecular weight of 183.30 g/mol. Its IUPAC name is 4-hydrazinyl-N,N,3-trimethylhept-6-yn-3-amine.

Molecular Properties

Compound Name4-hydrazinyl-N,N,3-trimethylhept-6-yn-3-amine
PubChem CID105240612
Molecular FormulaC10H21N3
Molecular Weight183.30 g/mol
Exact Mass183.17
IUPAC Name4-hydrazinyl-N,N,3-trimethylhept-6-yn-3-amine
SMILESC#CCC(NN)C(C)(CC)N(C)C
InChIInChI=1S/C10H21N3/c1-6-8-9(12-11)10(3,7-2)13(4)5/h1,9,12H,7-8,11H2,2-5H3
InChIKeyVVVRGCYCJMNPQL-UHFFFAOYSA-N
XLogP0.57
TPSA41.29 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.30
LogP ≤ 50.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

(5-methoxy-5-methylhept-1-yn-4-yl)hydrazine
CID 105274464
(5-ethoxy-5-methylhept-1-yn-4-yl)hydrazine
CID 105274802
3-N,3-N-diethyl-4-N,3-dimethylhept-6-yne-3,4-diamine
CID 79069459
2-hydrazinyl-1-(4-iodophenyl)-N,N,3-trimethylpentan-3-amine
CID 105240562
3-N,3-N-diethyl-3-methylhept-6-yne-3,4-diamine
CID 79068904
1-(3,4-dimethylphenyl)-2-hydrazinyl-N,N,3-trimethylpentan-3-amine
CID 105240604
1-(2,4-difluorophenyl)-2-hydrazinyl-N,N,3-trimethylpentan-3-amine
CID 105240669
1-cycloheptyl-1-hydrazinyl-N,N,2-trimethylbutan-2-amine
CID 105240548
3-N,3-N,4-N,3-tetramethylhept-6-ene-3,4-diamine
CID 79063149
3-N,3-N,3,6-tetramethylheptane-3,4-diamine
CID 79063853
N,2,3-trimethyl-N-prop-2-ynylpentan-3-amine
CID 163672798
1-cyclohexyl-3-N,4-N,4-N,4-tetramethylhexane-3,4-diamine
CID 114192155

Frequently Asked Questions

What is the IUPAC name of 4-hydrazinyl-N,N,3-trimethylhept-6-yn-3-amine?
The IUPAC name of 4-hydrazinyl-N,N,3-trimethylhept-6-yn-3-amine (CID 105240612) is 4-hydrazinyl-N,N,3-trimethylhept-6-yn-3-amine.
What is the SMILES notation for 4-hydrazinyl-N,N,3-trimethylhept-6-yn-3-amine?
The canonical SMILES for 4-hydrazinyl-N,N,3-trimethylhept-6-yn-3-amine is C#CCC(NN)C(C)(CC)N(C)C.
What is the InChIKey of 4-hydrazinyl-N,N,3-trimethylhept-6-yn-3-amine?
The InChIKey is VVVRGCYCJMNPQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21N3/c1-6-8-9(12-11)10(3,7-2)13(4)5/h1,9,12H,7-8,11H2,2-5H3.
What are the key properties of 4-hydrazinyl-N,N,3-trimethylhept-6-yn-3-amine?
4-hydrazinyl-N,N,3-trimethylhept-6-yn-3-amine has a molecular weight of 183.30 g/mol, XLogP of 0.57, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydrazinyl-N,N,3-trimethylhept-6-yn-3-amine is sourced from PubChem (CID 105240612), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).