[1-quinolin-7-yl-3-(2,2,2-trifluoroethoxy)propyl]hydrazine

C14H16F3N3O — CID 103151703

IUPAC[1-quinolin-7-yl-3-(2,2,2-trifluoroethoxy)propyl]hydrazine
SMILESNNC(CCOCC(F)(F)F)c1ccc2cccnc2c1
InChIInChI=1S/C14H16F3N3O/c15-14(16,17)9-21-7-5-12(20-18)11-4-3-10-2-1-6-19-13(10)8-11/h1-4,6,8,12,20H,5,7,9,18H2
InChIKeyWXGGFOABKWDITF-UHFFFAOYSA-N
MW299.30 g/mol
LogP2.71
Rot. Bonds6

About [1-quinolin-7-yl-3-(2,2,2-trifluoroethoxy)propyl]hydrazine

[1-quinolin-7-yl-3-(2,2,2-trifluoroethoxy)propyl]hydrazine (PubChem CID 103151703) has the molecular formula C14H16F3N3O and a molecular weight of 299.30 g/mol. Its IUPAC name is [1-quinolin-7-yl-3-(2,2,2-trifluoroethoxy)propyl]hydrazine.

Molecular Properties

Compound Name[1-quinolin-7-yl-3-(2,2,2-trifluoroethoxy)propyl]hydrazine
PubChem CID103151703
Molecular FormulaC14H16F3N3O
Molecular Weight299.30 g/mol
Exact Mass299.12
IUPAC Name[1-quinolin-7-yl-3-(2,2,2-trifluoroethoxy)propyl]hydrazine
SMILESNNC(CCOCC(F)(F)F)c1ccc2cccnc2c1
InChIInChI=1S/C14H16F3N3O/c15-14(16,17)9-21-7-5-12(20-18)11-4-3-10-2-1-6-19-13(10)8-11/h1-4,6,8,12,20H,5,7,9,18H2
InChIKeyWXGGFOABKWDITF-UHFFFAOYSA-N
XLogP2.71
TPSA60.17 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.30
LogP ≤ 52.71
H-Bond Donors ≤ 52
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

(2-methoxy-1-quinolin-7-ylethyl)hydrazine
CID 105207158
3-ethoxy-N-ethyl-1-quinolin-7-ylpropan-1-amine
CID 105172706
[3-(2,2,2-trifluoroethoxy)-1-[4-(trifluoromethyl)phenyl]propyl]hydrazine
CID 103151641
(3-pyridin-3-yl-1-quinolin-7-ylpropyl)hydrazine
CID 105327570
(2-cyclopentyl-1-quinolin-7-ylethyl)hydrazine
CID 105327558
(2-ethyl-2-methoxy-1-quinolin-7-ylbutyl)hydrazine
CID 105275332
(2-ethoxy-2-methyl-1-quinolin-7-ylpropyl)hydrazine
CID 105274011
3-amino-1-quinolin-7-ylpropan-1-ol
CID 84670752
[1-(2,4-difluorophenyl)-3-(2,2,2-trifluoroethoxy)propyl]hydrazine
CID 103151492
(3-pyridin-4-yl-1-quinolin-6-ylpropyl)hydrazine
CID 105327345
N-methyl-2-phenylsulfanyl-1-quinolin-7-ylethanamine
CID 81228674
2,2-dimethyl-1-quinolin-7-ylpropan-1-amine
CID 81220535

Frequently Asked Questions

What is the IUPAC name of [1-quinolin-7-yl-3-(2,2,2-trifluoroethoxy)propyl]hydrazine?
The IUPAC name of [1-quinolin-7-yl-3-(2,2,2-trifluoroethoxy)propyl]hydrazine (CID 103151703) is [1-quinolin-7-yl-3-(2,2,2-trifluoroethoxy)propyl]hydrazine.
What is the SMILES notation for [1-quinolin-7-yl-3-(2,2,2-trifluoroethoxy)propyl]hydrazine?
The canonical SMILES for [1-quinolin-7-yl-3-(2,2,2-trifluoroethoxy)propyl]hydrazine is NNC(CCOCC(F)(F)F)c1ccc2cccnc2c1.
What is the InChIKey of [1-quinolin-7-yl-3-(2,2,2-trifluoroethoxy)propyl]hydrazine?
The InChIKey is WXGGFOABKWDITF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16F3N3O/c15-14(16,17)9-21-7-5-12(20-18)11-4-3-10-2-1-6-19-13(10)8-11/h1-4,6,8,12,20H,5,7,9,18H2.
What are the key properties of [1-quinolin-7-yl-3-(2,2,2-trifluoroethoxy)propyl]hydrazine?
[1-quinolin-7-yl-3-(2,2,2-trifluoroethoxy)propyl]hydrazine has a molecular weight of 299.30 g/mol, XLogP of 2.71, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-quinolin-7-yl-3-(2,2,2-trifluoroethoxy)propyl]hydrazine is sourced from PubChem (CID 103151703), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).