1-[2-(2-methylhexyl)hydrazinyl]-N-propylpentan-1-amine

C15H35N3 — CID 123445154

IUPAC1-[2-(2-methylhexyl)hydrazinyl]-N-propylpentan-1-amine
SMILESCCCCC(C)CNNC(CCCC)NCCC
InChIInChI=1S/C15H35N3/c1-5-8-10-14(4)13-17-18-15(11-9-6-2)16-12-7-3/h14-18H,5-13H2,1-4H3
InChIKeyISFWUMDYMIYJJF-UHFFFAOYSA-N
MW257.47 g/mol
LogP3.42
Rot. Bonds13

About 1-[2-(2-methylhexyl)hydrazinyl]-N-propylpentan-1-amine

1-[2-(2-methylhexyl)hydrazinyl]-N-propylpentan-1-amine (PubChem CID 123445154) has the molecular formula C15H35N3 and a molecular weight of 257.47 g/mol. Its IUPAC name is 1-[2-(2-methylhexyl)hydrazinyl]-N-propylpentan-1-amine.

Molecular Properties

Compound Name1-[2-(2-methylhexyl)hydrazinyl]-N-propylpentan-1-amine
PubChem CID123445154
Molecular FormulaC15H35N3
Molecular Weight257.47 g/mol
Exact Mass257.28
IUPAC Name1-[2-(2-methylhexyl)hydrazinyl]-N-propylpentan-1-amine
SMILESCCCCC(C)CNNC(CCCC)NCCC
InChIInChI=1S/C15H35N3/c1-5-8-10-14(4)13-17-18-15(11-9-6-2)16-12-7-3/h14-18H,5-13H2,1-4H3
InChIKeyISFWUMDYMIYJJF-UHFFFAOYSA-N
XLogP3.42
TPSA36.09 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds13
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.47
LogP ≤ 53.42
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', '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 1-[2-(2-methylhexyl)hydrazinyl]-N-propylpentan-1-amine?
The IUPAC name of 1-[2-(2-methylhexyl)hydrazinyl]-N-propylpentan-1-amine (CID 123445154) is 1-[2-(2-methylhexyl)hydrazinyl]-N-propylpentan-1-amine.
What is the SMILES notation for 1-[2-(2-methylhexyl)hydrazinyl]-N-propylpentan-1-amine?
The canonical SMILES for 1-[2-(2-methylhexyl)hydrazinyl]-N-propylpentan-1-amine is CCCCC(C)CNNC(CCCC)NCCC.
What is the InChIKey of 1-[2-(2-methylhexyl)hydrazinyl]-N-propylpentan-1-amine?
The InChIKey is ISFWUMDYMIYJJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H35N3/c1-5-8-10-14(4)13-17-18-15(11-9-6-2)16-12-7-3/h14-18H,5-13H2,1-4H3.
What are the key properties of 1-[2-(2-methylhexyl)hydrazinyl]-N-propylpentan-1-amine?
1-[2-(2-methylhexyl)hydrazinyl]-N-propylpentan-1-amine has a molecular weight of 257.47 g/mol, XLogP of 3.42, 13 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(2-methylhexyl)hydrazinyl]-N-propylpentan-1-amine is sourced from PubChem (CID 123445154), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).