N-(2,3-dimethoxypropyl)-6-hydrazinyl-4-(trifluoromethyl)pyridin-2-amine

C11H17F3N4O2 — CID 114102576

IUPACN-(2,3-dimethoxypropyl)-6-hydrazinyl-4-(trifluoromethyl)pyridin-2-amine
SMILESCOCC(CNc1cc(C(F)(F)F)cc(NN)n1)OC
InChIInChI=1S/C11H17F3N4O2/c1-19-6-8(20-2)5-16-9-3-7(11(12,13)14)4-10(17-9)18-15/h3-4,8H,5-6,15H2,1-2H3,(H2,16,17,18)
InChIKeyDGYOVNOSCGIVGN-UHFFFAOYSA-N
MW294.28 g/mol
LogP1.46
Rot. Bonds7

About N-(2,3-dimethoxypropyl)-6-hydrazinyl-4-(trifluoromethyl)pyridin-2-amine

N-(2,3-dimethoxypropyl)-6-hydrazinyl-4-(trifluoromethyl)pyridin-2-amine (PubChem CID 114102576) has the molecular formula C11H17F3N4O2 and a molecular weight of 294.28 g/mol. Its IUPAC name is N-(2,3-dimethoxypropyl)-6-hydrazinyl-4-(trifluoromethyl)pyridin-2-amine.

Molecular Properties

Compound NameN-(2,3-dimethoxypropyl)-6-hydrazinyl-4-(trifluoromethyl)pyridin-2-amine
PubChem CID114102576
Molecular FormulaC11H17F3N4O2
Molecular Weight294.28 g/mol
Exact Mass294.13
IUPAC NameN-(2,3-dimethoxypropyl)-6-hydrazinyl-4-(trifluoromethyl)pyridin-2-amine
SMILESCOCC(CNc1cc(C(F)(F)F)cc(NN)n1)OC
InChIInChI=1S/C11H17F3N4O2/c1-19-6-8(20-2)5-16-9-3-7(11(12,13)14)4-10(17-9)18-15/h3-4,8H,5-6,15H2,1-2H3,(H2,16,17,18)
InChIKeyDGYOVNOSCGIVGN-UHFFFAOYSA-N
XLogP1.46
TPSA81.43 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.28
LogP ≤ 51.46
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

1-[[6-hydrazinyl-4-(trifluoromethyl)-2-pyridinyl]amino]-3-methoxypropan-2-ol
CID 102720773
N-(2,3-dimethylbutyl)-6-hydrazinyl-4-(trifluoromethyl)pyridin-2-amine
CID 102720794
6-N-(2-methoxypropyl)-2-N-methyl-4-(trifluoromethyl)pyridine-2,6-diamine
CID 102719521
N-hexyl-6-hydrazinyl-4-(trifluoromethyl)pyridin-2-amine
CID 102720771
6-hydrazinyl-4-(trifluoromethyl)-N-(2,4,4-trimethylpentan-2-yl)pyridin-2-amine
CID 102720633
N-[6-hydrazinyl-4-(trifluoromethyl)-2-pyridinyl]-N',N'-dimethylpropane-1,3-diamine
CID 102721008
3-[[6-hydrazinyl-4-(trifluoromethyl)-2-pyridinyl]amino]propanamide
CID 102720469
6-hydrazinyl-4-(trifluoromethyl)-N-[2-(trifluoromethylsulfanyl)ethyl]pyridin-2-amine
CID 106434144
N-benzyl-6-hydrazinyl-4-(trifluoromethyl)pyridin-2-amine
CID 102720987
6-hydrazinyl-N-(5-methylhexan-2-yl)-4-(trifluoromethyl)pyridin-2-amine
CID 102720760
[6-(3-methylbutoxy)-4-(trifluoromethyl)-2-pyridinyl]hydrazine
CID 102721220
1-[[6-hydrazinyl-4-(trifluoromethyl)-2-pyridinyl]amino]-2-methylpentan-2-ol
CID 106294581

Frequently Asked Questions

What is the IUPAC name of N-(2,3-dimethoxypropyl)-6-hydrazinyl-4-(trifluoromethyl)pyridin-2-amine?
The IUPAC name of N-(2,3-dimethoxypropyl)-6-hydrazinyl-4-(trifluoromethyl)pyridin-2-amine (CID 114102576) is N-(2,3-dimethoxypropyl)-6-hydrazinyl-4-(trifluoromethyl)pyridin-2-amine.
What is the SMILES notation for N-(2,3-dimethoxypropyl)-6-hydrazinyl-4-(trifluoromethyl)pyridin-2-amine?
The canonical SMILES for N-(2,3-dimethoxypropyl)-6-hydrazinyl-4-(trifluoromethyl)pyridin-2-amine is COCC(CNc1cc(C(F)(F)F)cc(NN)n1)OC.
What is the InChIKey of N-(2,3-dimethoxypropyl)-6-hydrazinyl-4-(trifluoromethyl)pyridin-2-amine?
The InChIKey is DGYOVNOSCGIVGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17F3N4O2/c1-19-6-8(20-2)5-16-9-3-7(11(12,13)14)4-10(17-9)18-15/h3-4,8H,5-6,15H2,1-2H3,(H2,16,17,18).
What are the key properties of N-(2,3-dimethoxypropyl)-6-hydrazinyl-4-(trifluoromethyl)pyridin-2-amine?
N-(2,3-dimethoxypropyl)-6-hydrazinyl-4-(trifluoromethyl)pyridin-2-amine has a molecular weight of 294.28 g/mol, XLogP of 1.46, 7 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dimethoxypropyl)-6-hydrazinyl-4-(trifluoromethyl)pyridin-2-amine is sourced from PubChem (CID 114102576), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).