N-(2-chloro-6-methylphenyl)-3,5-difluoro-6-hydrazinylpyridin-2-amine

C12H11ClF2N4 — CID 114073334

IUPACN-(2-chloro-6-methylphenyl)-3,5-difluoro-6-hydrazinylpyridin-2-amine
SMILESCc1cccc(Cl)c1Nc1nc(NN)c(F)cc1F
InChIInChI=1S/C12H11ClF2N4/c1-6-3-2-4-7(13)10(6)17-11-8(14)5-9(15)12(18-11)19-16/h2-5H,16H2,1H3,(H2,17,18,19)
InChIKeyXVAQLYZQDIWXPV-UHFFFAOYSA-N
MW284.70 g/mol
LogP3.35
Rot. Bonds3

About N-(2-chloro-6-methylphenyl)-3,5-difluoro-6-hydrazinylpyridin-2-amine

N-(2-chloro-6-methylphenyl)-3,5-difluoro-6-hydrazinylpyridin-2-amine (PubChem CID 114073334) has the molecular formula C12H11ClF2N4 and a molecular weight of 284.70 g/mol. Its IUPAC name is N-(2-chloro-6-methylphenyl)-3,5-difluoro-6-hydrazinylpyridin-2-amine.

Molecular Properties

Compound NameN-(2-chloro-6-methylphenyl)-3,5-difluoro-6-hydrazinylpyridin-2-amine
PubChem CID114073334
Molecular FormulaC12H11ClF2N4
Molecular Weight284.70 g/mol
Exact Mass284.06
IUPAC NameN-(2-chloro-6-methylphenyl)-3,5-difluoro-6-hydrazinylpyridin-2-amine
SMILESCc1cccc(Cl)c1Nc1nc(NN)c(F)cc1F
InChIInChI=1S/C12H11ClF2N4/c1-6-3-2-4-7(13)10(6)17-11-8(14)5-9(15)12(18-11)19-16/h2-5H,16H2,1H3,(H2,17,18,19)
InChIKeyXVAQLYZQDIWXPV-UHFFFAOYSA-N
XLogP3.35
TPSA62.97 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.70
LogP ≤ 53.35
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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

3,5-dichloro-N-(2-chloro-6-methylphenyl)-6-hydrazinylpyridin-2-amine
CID 102762246
6-chloro-N-(2-chloro-6-methylphenyl)-2,5-dimethylpyrimidin-4-amine
CID 66256721
2-chloro-N-(2-chloro-6-methylphenyl)-5-methylpyrimidin-4-amine
CID 79073312
5-bromo-2-chloro-N-(2-chloro-6-methylphenyl)pyrimidin-4-amine
CID 79073311
6-chloro-4-N-(2-chloro-6-methylphenyl)pyrimidine-4,5-diamine
CID 66251442
N-(2-bromo-5-chlorophenyl)-3,5-difluoro-6-hydrazinylpyridin-2-amine
CID 114073489
5-chloro-N-(2,6-dichlorophenyl)-3-fluoropyridin-2-amine
CID 79727188
N-(2-chloro-6-methylphenyl)-3,5-difluoro-4-hydrazinylbenzamide
CID 66255840
4-chloro-2-N-(2-chloro-6-methylphenyl)benzene-1,2-diamine
CID 115469101
3,5-dichloro-6-hydrazinyl-N-(2,4,6-trifluorophenyl)pyridin-2-amine
CID 102762228
N-(2-chloro-4,6-difluorophenyl)-6-hydrazinyl-2,5-dimethylpyrimidin-4-amine
CID 83082819
3,5-difluoro-6-N-(2-fluoro-3-methylphenyl)pyridine-2,6-diamine
CID 114254240

Frequently Asked Questions

What is the IUPAC name of N-(2-chloro-6-methylphenyl)-3,5-difluoro-6-hydrazinylpyridin-2-amine?
The IUPAC name of N-(2-chloro-6-methylphenyl)-3,5-difluoro-6-hydrazinylpyridin-2-amine (CID 114073334) is N-(2-chloro-6-methylphenyl)-3,5-difluoro-6-hydrazinylpyridin-2-amine.
What is the SMILES notation for N-(2-chloro-6-methylphenyl)-3,5-difluoro-6-hydrazinylpyridin-2-amine?
The canonical SMILES for N-(2-chloro-6-methylphenyl)-3,5-difluoro-6-hydrazinylpyridin-2-amine is Cc1cccc(Cl)c1Nc1nc(NN)c(F)cc1F.
What is the InChIKey of N-(2-chloro-6-methylphenyl)-3,5-difluoro-6-hydrazinylpyridin-2-amine?
The InChIKey is XVAQLYZQDIWXPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11ClF2N4/c1-6-3-2-4-7(13)10(6)17-11-8(14)5-9(15)12(18-11)19-16/h2-5H,16H2,1H3,(H2,17,18,19).
What are the key properties of N-(2-chloro-6-methylphenyl)-3,5-difluoro-6-hydrazinylpyridin-2-amine?
N-(2-chloro-6-methylphenyl)-3,5-difluoro-6-hydrazinylpyridin-2-amine has a molecular weight of 284.70 g/mol, XLogP of 3.35, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-chloro-6-methylphenyl)-3,5-difluoro-6-hydrazinylpyridin-2-amine is sourced from PubChem (CID 114073334), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).