[1-(2,3-difluorophenyl)-4-methylheptan-2-yl]hydrazine

C14H22F2N2 — CID 105298128

IUPAC[1-(2,3-difluorophenyl)-4-methylheptan-2-yl]hydrazine
SMILESCCCC(C)CC(Cc1cccc(F)c1F)NN
InChIInChI=1S/C14H22F2N2/c1-3-5-10(2)8-12(18-17)9-11-6-4-7-13(15)14(11)16/h4,6-7,10,12,18H,3,5,8-9,17H2,1-2H3
InChIKeyNDQGZTDGNCAECP-UHFFFAOYSA-N
MW256.34 g/mol
LogP3.17
Rot. Bonds7

About [1-(2,3-difluorophenyl)-4-methylheptan-2-yl]hydrazine

[1-(2,3-difluorophenyl)-4-methylheptan-2-yl]hydrazine (PubChem CID 105298128) has the molecular formula C14H22F2N2 and a molecular weight of 256.34 g/mol. Its IUPAC name is [1-(2,3-difluorophenyl)-4-methylheptan-2-yl]hydrazine.

Molecular Properties

Compound Name[1-(2,3-difluorophenyl)-4-methylheptan-2-yl]hydrazine
PubChem CID105298128
Molecular FormulaC14H22F2N2
Molecular Weight256.34 g/mol
Exact Mass256.18
IUPAC Name[1-(2,3-difluorophenyl)-4-methylheptan-2-yl]hydrazine
SMILESCCCC(C)CC(Cc1cccc(F)c1F)NN
InChIInChI=1S/C14H22F2N2/c1-3-5-10(2)8-12(18-17)9-11-6-4-7-13(15)14(11)16/h4,6-7,10,12,18H,3,5,8-9,17H2,1-2H3
InChIKeyNDQGZTDGNCAECP-UHFFFAOYSA-N
XLogP3.17
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.34
LogP ≤ 53.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze [1-(2,3-difluorophenyl)-4-methylheptan-2-yl]hydrazine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

[1-(2,3-difluorophenyl)-4,6,6-trimethylheptan-2-yl]hydrazine
CID 105297922
[1-(2-chloro-6-fluorophenyl)-4-methylheptan-2-yl]hydrazine
CID 105215968
[1-(2-methoxyphenyl)-4-methylheptan-2-yl]hydrazine
CID 105205005
4-(2,3-difluorophenyl)-N,N-diethyl-3-hydrazinylbutan-1-amine
CID 105244189
4-(2,3-difluorophenyl)-3-hydrazinyl-N,N-dimethylbutan-1-amine
CID 105259354
3-(2,3-difluorophenyl)-2-hydrazinyl-N,N-dimethylpropan-1-amine
CID 105244886
1-(2,3-difluorophenyl)pentan-2-amine
CID 62601447
1-(2-fluorophenyl)hexan-2-ylhydrazine
CID 105206821
[1-(2,3-difluorophenyl)-3-ethoxyhexan-2-yl]hydrazine
CID 105271512
[1-(2,3-difluorophenyl)-4-(3-methylphenyl)butan-2-yl]hydrazine
CID 105298035
[1-(2,6-dichlorophenyl)-3-(2,3-difluorophenyl)propan-2-yl]hydrazine
CID 105209834
[1-(2-chloro-3-fluorophenyl)-4-methylpentan-2-yl]hydrazine
CID 105198841

Frequently Asked Questions

What is the IUPAC name of [1-(2,3-difluorophenyl)-4-methylheptan-2-yl]hydrazine?
The IUPAC name of [1-(2,3-difluorophenyl)-4-methylheptan-2-yl]hydrazine (CID 105298128) is [1-(2,3-difluorophenyl)-4-methylheptan-2-yl]hydrazine.
What is the SMILES notation for [1-(2,3-difluorophenyl)-4-methylheptan-2-yl]hydrazine?
The canonical SMILES for [1-(2,3-difluorophenyl)-4-methylheptan-2-yl]hydrazine is CCCC(C)CC(Cc1cccc(F)c1F)NN.
What is the InChIKey of [1-(2,3-difluorophenyl)-4-methylheptan-2-yl]hydrazine?
The InChIKey is NDQGZTDGNCAECP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22F2N2/c1-3-5-10(2)8-12(18-17)9-11-6-4-7-13(15)14(11)16/h4,6-7,10,12,18H,3,5,8-9,17H2,1-2H3.
What are the key properties of [1-(2,3-difluorophenyl)-4-methylheptan-2-yl]hydrazine?
[1-(2,3-difluorophenyl)-4-methylheptan-2-yl]hydrazine has a molecular weight of 256.34 g/mol, XLogP of 3.17, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(2,3-difluorophenyl)-4-methylheptan-2-yl]hydrazine is sourced from PubChem (CID 105298128), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).