1-(2,4-difluorophenyl)-2-hydrazinyl-N,N,3-trimethylpentan-3-amine

C14H23F2N3 — CID 105240669

IUPAC1-(2,4-difluorophenyl)-2-hydrazinyl-N,N,3-trimethylpentan-3-amine
SMILESCCC(C)(C(Cc1ccc(F)cc1F)NN)N(C)C
InChIInChI=1S/C14H23F2N3/c1-5-14(2,19(3)4)13(18-17)8-10-6-7-11(15)9-12(10)16/h6-7,9,13,18H,5,8,17H2,1-4H3
InChIKeyBAZDTOTYTYRIPT-UHFFFAOYSA-N
MW271.36 g/mol
LogP2.07
Rot. Bonds6

About 1-(2,4-difluorophenyl)-2-hydrazinyl-N,N,3-trimethylpentan-3-amine

1-(2,4-difluorophenyl)-2-hydrazinyl-N,N,3-trimethylpentan-3-amine (PubChem CID 105240669) has the molecular formula C14H23F2N3 and a molecular weight of 271.36 g/mol. Its IUPAC name is 1-(2,4-difluorophenyl)-2-hydrazinyl-N,N,3-trimethylpentan-3-amine.

Molecular Properties

Compound Name1-(2,4-difluorophenyl)-2-hydrazinyl-N,N,3-trimethylpentan-3-amine
PubChem CID105240669
Molecular FormulaC14H23F2N3
Molecular Weight271.36 g/mol
Exact Mass271.19
IUPAC Name1-(2,4-difluorophenyl)-2-hydrazinyl-N,N,3-trimethylpentan-3-amine
SMILESCCC(C)(C(Cc1ccc(F)cc1F)NN)N(C)C
InChIInChI=1S/C14H23F2N3/c1-5-14(2,19(3)4)13(18-17)8-10-6-7-11(15)9-12(10)16/h6-7,9,13,18H,5,8,17H2,1-4H3
InChIKeyBAZDTOTYTYRIPT-UHFFFAOYSA-N
XLogP2.07
TPSA41.29 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.36
LogP ≤ 52.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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-(2,5-difluorophenyl)-2-N-ethyl-3-N,3-N,3-trimethylpentane-2,3-diamine
CID 79064460
1-(2,4-difluorophenyl)butan-2-ylhydrazine
CID 105201098
1-(3,4-dimethylphenyl)-2-hydrazinyl-N,N,3-trimethylpentan-3-amine
CID 105240604
2-hydrazinyl-1-(4-iodophenyl)-N,N,3-trimethylpentan-3-amine
CID 105240562
1-(5-chloro-2-fluorophenyl)-N,N-diethyl-2-hydrazinyl-3-methylpentan-3-amine
CID 103053634
[1-(7-bicyclo[4.1.0]heptanyl)-2-(2,4-difluorophenyl)ethyl]hydrazine
CID 105291870
1-(2,4-difluorophenyl)-3,3-dimethylbutan-2-amine
CID 62195909
1-(2,4-difluorophenyl)propan-2-amine;hydrochloride
CID 155973682
1-(2,4-difluorophenyl)hexan-2-ylhydrazine
CID 105223048
[1-(2,4-difluorophenyl)-3-(5-ethylthiophen-2-yl)propan-2-yl]hydrazine
CID 105223143
[1-(2-bromo-4-fluorophenyl)-3,3-dimethylbutan-2-yl]hydrazine
CID 105202997
[1-(4-fluoro-2-methylphenyl)-3-methyl-3-pyrrolidin-1-ylpentan-2-yl]hydrazine
CID 105241193

Frequently Asked Questions

What is the IUPAC name of 1-(2,4-difluorophenyl)-2-hydrazinyl-N,N,3-trimethylpentan-3-amine?
The IUPAC name of 1-(2,4-difluorophenyl)-2-hydrazinyl-N,N,3-trimethylpentan-3-amine (CID 105240669) is 1-(2,4-difluorophenyl)-2-hydrazinyl-N,N,3-trimethylpentan-3-amine.
What is the SMILES notation for 1-(2,4-difluorophenyl)-2-hydrazinyl-N,N,3-trimethylpentan-3-amine?
The canonical SMILES for 1-(2,4-difluorophenyl)-2-hydrazinyl-N,N,3-trimethylpentan-3-amine is CCC(C)(C(Cc1ccc(F)cc1F)NN)N(C)C.
What is the InChIKey of 1-(2,4-difluorophenyl)-2-hydrazinyl-N,N,3-trimethylpentan-3-amine?
The InChIKey is BAZDTOTYTYRIPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23F2N3/c1-5-14(2,19(3)4)13(18-17)8-10-6-7-11(15)9-12(10)16/h6-7,9,13,18H,5,8,17H2,1-4H3.
What are the key properties of 1-(2,4-difluorophenyl)-2-hydrazinyl-N,N,3-trimethylpentan-3-amine?
1-(2,4-difluorophenyl)-2-hydrazinyl-N,N,3-trimethylpentan-3-amine has a molecular weight of 271.36 g/mol, XLogP of 2.07, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,4-difluorophenyl)-2-hydrazinyl-N,N,3-trimethylpentan-3-amine is sourced from PubChem (CID 105240669), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).