2-hydrazinyl-N,N-dimethyl-4-methylidenehexan-1-amine

C9H21N3 — CID 105244895

IUPAC2-hydrazinyl-N,N-dimethyl-4-methylidenehexan-1-amine
SMILESC=C(CC)CC(CN(C)C)NN
InChIInChI=1S/C9H21N3/c1-5-8(2)6-9(11-10)7-12(3)4/h9,11H,2,5-7,10H2,1,3-4H3
InChIKeyQNZLNXYSLJUGSU-UHFFFAOYSA-N
MW171.29 g/mol
LogP0.74
Rot. Bonds6

About 2-hydrazinyl-N,N-dimethyl-4-methylidenehexan-1-amine

2-hydrazinyl-N,N-dimethyl-4-methylidenehexan-1-amine (PubChem CID 105244895) has the molecular formula C9H21N3 and a molecular weight of 171.29 g/mol. Its IUPAC name is 2-hydrazinyl-N,N-dimethyl-4-methylidenehexan-1-amine.

Molecular Properties

Compound Name2-hydrazinyl-N,N-dimethyl-4-methylidenehexan-1-amine
PubChem CID105244895
Molecular FormulaC9H21N3
Molecular Weight171.29 g/mol
Exact Mass171.17
IUPAC Name2-hydrazinyl-N,N-dimethyl-4-methylidenehexan-1-amine
SMILESC=C(CC)CC(CN(C)C)NN
InChIInChI=1S/C9H21N3/c1-5-8(2)6-9(11-10)7-12(3)4/h9,11H,2,5-7,10H2,1,3-4H3
InChIKeyQNZLNXYSLJUGSU-UHFFFAOYSA-N
XLogP0.74
TPSA41.29 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
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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Frequently Asked Questions

What is the IUPAC name of 2-hydrazinyl-N,N-dimethyl-4-methylidenehexan-1-amine?
The IUPAC name of 2-hydrazinyl-N,N-dimethyl-4-methylidenehexan-1-amine (CID 105244895) is 2-hydrazinyl-N,N-dimethyl-4-methylidenehexan-1-amine.
What is the SMILES notation for 2-hydrazinyl-N,N-dimethyl-4-methylidenehexan-1-amine?
The canonical SMILES for 2-hydrazinyl-N,N-dimethyl-4-methylidenehexan-1-amine is C=C(CC)CC(CN(C)C)NN.
What is the InChIKey of 2-hydrazinyl-N,N-dimethyl-4-methylidenehexan-1-amine?
The InChIKey is QNZLNXYSLJUGSU-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H21N3/c1-5-8(2)6-9(11-10)7-12(3)4/h9,11H,2,5-7,10H2,1,3-4H3.
What are the key properties of 2-hydrazinyl-N,N-dimethyl-4-methylidenehexan-1-amine?
2-hydrazinyl-N,N-dimethyl-4-methylidenehexan-1-amine has a molecular weight of 171.29 g/mol, XLogP of 0.74, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydrazinyl-N,N-dimethyl-4-methylidenehexan-1-amine is sourced from PubChem (CID 105244895), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).