N-hexyl-6-hydrazinyl-4-(trifluoromethyl)pyridin-2-amine

C12H19F3N4 — CID 102720771

IUPACN-hexyl-6-hydrazinyl-4-(trifluoromethyl)pyridin-2-amine
SMILESCCCCCCNc1cc(C(F)(F)F)cc(NN)n1
InChIInChI=1S/C12H19F3N4/c1-2-3-4-5-6-17-10-7-9(12(13,14)15)8-11(18-10)19-16/h7-8H,2-6,16H2,1H3,(H2,17,18,19)
InChIKeyBBVDZMOGYKJIBQ-UHFFFAOYSA-N
MW276.31 g/mol
LogP3.38
Rot. Bonds7

About N-hexyl-6-hydrazinyl-4-(trifluoromethyl)pyridin-2-amine

N-hexyl-6-hydrazinyl-4-(trifluoromethyl)pyridin-2-amine (PubChem CID 102720771) has the molecular formula C12H19F3N4 and a molecular weight of 276.31 g/mol. Its IUPAC name is N-hexyl-6-hydrazinyl-4-(trifluoromethyl)pyridin-2-amine.

Molecular Properties

Compound NameN-hexyl-6-hydrazinyl-4-(trifluoromethyl)pyridin-2-amine
PubChem CID102720771
Molecular FormulaC12H19F3N4
Molecular Weight276.31 g/mol
Exact Mass276.16
IUPAC NameN-hexyl-6-hydrazinyl-4-(trifluoromethyl)pyridin-2-amine
SMILESCCCCCCNc1cc(C(F)(F)F)cc(NN)n1
InChIInChI=1S/C12H19F3N4/c1-2-3-4-5-6-17-10-7-9(12(13,14)15)8-11(18-10)19-16/h7-8H,2-6,16H2,1H3,(H2,17,18,19)
InChIKeyBBVDZMOGYKJIBQ-UHFFFAOYSA-N
XLogP3.38
TPSA62.97 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.31
LogP ≤ 53.38
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

6-N-butyl-2-N-ethyl-4-(trifluoromethyl)pyridine-2,6-diamine
CID 102717307
N-[6-hydrazinyl-4-(trifluoromethyl)-2-pyridinyl]-N',N'-dimethylpropane-1,3-diamine
CID 102721008
5-[[6-(propylamino)-4-(trifluoromethyl)-2-pyridinyl]amino]pentan-1-ol
CID 107324249
6-hydrazinyl-2-methyl-N-pentylpyrimidin-4-amine
CID 80932312
6-hydrazinyl-N-octyl-2-propylpyrimidin-4-amine
CID 115565446
N-octyl-4-(trifluoromethyl)pyridin-2-amine
CID 115568897
3-[[6-hydrazinyl-4-(trifluoromethyl)-2-pyridinyl]amino]propanamide
CID 102720469
6-hydrazinyl-4-(trifluoromethyl)-N-[2-(trifluoromethylsulfanyl)ethyl]pyridin-2-amine
CID 106434144
1-[[6-hydrazinyl-4-(trifluoromethyl)-2-pyridinyl]amino]-2-methylpentan-2-ol
CID 106294581
2-[[6-hydrazinyl-4-(trifluoromethyl)-2-pyridinyl]amino]ethylurea
CID 102721067
2-N-propyl-6-N-(2,2,2-trifluoroethyl)-4-(trifluoromethyl)pyridine-2,6-diamine
CID 102717325
N-(2,3-dimethylbutyl)-6-hydrazinyl-4-(trifluoromethyl)pyridin-2-amine
CID 102720794

Frequently Asked Questions

What is the IUPAC name of N-hexyl-6-hydrazinyl-4-(trifluoromethyl)pyridin-2-amine?
The IUPAC name of N-hexyl-6-hydrazinyl-4-(trifluoromethyl)pyridin-2-amine (CID 102720771) is N-hexyl-6-hydrazinyl-4-(trifluoromethyl)pyridin-2-amine.
What is the SMILES notation for N-hexyl-6-hydrazinyl-4-(trifluoromethyl)pyridin-2-amine?
The canonical SMILES for N-hexyl-6-hydrazinyl-4-(trifluoromethyl)pyridin-2-amine is CCCCCCNc1cc(C(F)(F)F)cc(NN)n1.
What is the InChIKey of N-hexyl-6-hydrazinyl-4-(trifluoromethyl)pyridin-2-amine?
The InChIKey is BBVDZMOGYKJIBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19F3N4/c1-2-3-4-5-6-17-10-7-9(12(13,14)15)8-11(18-10)19-16/h7-8H,2-6,16H2,1H3,(H2,17,18,19).
What are the key properties of N-hexyl-6-hydrazinyl-4-(trifluoromethyl)pyridin-2-amine?
N-hexyl-6-hydrazinyl-4-(trifluoromethyl)pyridin-2-amine has a molecular weight of 276.31 g/mol, XLogP of 3.38, 7 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-hexyl-6-hydrazinyl-4-(trifluoromethyl)pyridin-2-amine is sourced from PubChem (CID 102720771), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).