6-[2-(6-aminohexyl)hydrazinyl]-2,2,4-trimethylhexan-1-amine

C15H36N4 — CID 56975988

IUPAC6-[2-(6-aminohexyl)hydrazinyl]-2,2,4-trimethylhexan-1-amine
SMILESCC(CCNNCCCCCCN)CC(C)(C)CN
InChIInChI=1S/C15H36N4/c1-14(12-15(2,3)13-17)8-11-19-18-10-7-5-4-6-9-16/h14,18-19H,4-13,16-17H2,1-3H3
InChIKeyOXDYJCNLSNIFPT-UHFFFAOYSA-N
MW272.48 g/mol
LogP2.00
Rot. Bonds13

About 6-[2-(6-aminohexyl)hydrazinyl]-2,2,4-trimethylhexan-1-amine

6-[2-(6-aminohexyl)hydrazinyl]-2,2,4-trimethylhexan-1-amine (PubChem CID 56975988) has the molecular formula C15H36N4 and a molecular weight of 272.48 g/mol. Its IUPAC name is 6-[2-(6-aminohexyl)hydrazinyl]-2,2,4-trimethylhexan-1-amine.

Molecular Properties

Compound Name6-[2-(6-aminohexyl)hydrazinyl]-2,2,4-trimethylhexan-1-amine
PubChem CID56975988
Molecular FormulaC15H36N4
Molecular Weight272.48 g/mol
Exact Mass272.29
IUPAC Name6-[2-(6-aminohexyl)hydrazinyl]-2,2,4-trimethylhexan-1-amine
SMILESCC(CCNNCCCCCCN)CC(C)(C)CN
InChIInChI=1S/C15H36N4/c1-14(12-15(2,3)13-17)8-11-19-18-10-7-5-4-6-9-16/h14,18-19H,4-13,16-17H2,1-3H3
InChIKeyOXDYJCNLSNIFPT-UHFFFAOYSA-N
XLogP2.00
TPSA76.10 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds13
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.48
LogP ≤ 52.00
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', '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 6-[2-(6-aminohexyl)hydrazinyl]-2,2,4-trimethylhexan-1-amine?
The IUPAC name of 6-[2-(6-aminohexyl)hydrazinyl]-2,2,4-trimethylhexan-1-amine (CID 56975988) is 6-[2-(6-aminohexyl)hydrazinyl]-2,2,4-trimethylhexan-1-amine.
What is the SMILES notation for 6-[2-(6-aminohexyl)hydrazinyl]-2,2,4-trimethylhexan-1-amine?
The canonical SMILES for 6-[2-(6-aminohexyl)hydrazinyl]-2,2,4-trimethylhexan-1-amine is CC(CCNNCCCCCCN)CC(C)(C)CN.
What is the InChIKey of 6-[2-(6-aminohexyl)hydrazinyl]-2,2,4-trimethylhexan-1-amine?
The InChIKey is OXDYJCNLSNIFPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H36N4/c1-14(12-15(2,3)13-17)8-11-19-18-10-7-5-4-6-9-16/h14,18-19H,4-13,16-17H2,1-3H3.
What are the key properties of 6-[2-(6-aminohexyl)hydrazinyl]-2,2,4-trimethylhexan-1-amine?
6-[2-(6-aminohexyl)hydrazinyl]-2,2,4-trimethylhexan-1-amine has a molecular weight of 272.48 g/mol, XLogP of 2.00, 13 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[2-(6-aminohexyl)hydrazinyl]-2,2,4-trimethylhexan-1-amine is sourced from PubChem (CID 56975988), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).