3-N-(2-chloro-4,6-difluorophenyl)pyrazine-2,3-diamine

C10H7ClF2N4 — CID 102987080

IUPAC3-N-(2-chloro-4,6-difluorophenyl)pyrazine-2,3-diamine
SMILESNc1nccnc1Nc1c(F)cc(F)cc1Cl
InChIInChI=1S/C10H7ClF2N4/c11-6-3-5(12)4-7(13)8(6)17-10-9(14)15-1-2-16-10/h1-4H,(H2,14,15)(H,16,17)
InChIKeyRLNBFLRRHXOBGR-UHFFFAOYSA-N
MW256.64 g/mol
LogP2.73
Rot. Bonds2

About 3-N-(2-chloro-4,6-difluorophenyl)pyrazine-2,3-diamine

3-N-(2-chloro-4,6-difluorophenyl)pyrazine-2,3-diamine (PubChem CID 102987080) has the molecular formula C10H7ClF2N4 and a molecular weight of 256.64 g/mol. Its IUPAC name is 3-N-(2-chloro-4,6-difluorophenyl)pyrazine-2,3-diamine.

Molecular Properties

Compound Name3-N-(2-chloro-4,6-difluorophenyl)pyrazine-2,3-diamine
PubChem CID102987080
Molecular FormulaC10H7ClF2N4
Molecular Weight256.64 g/mol
Exact Mass256.03
IUPAC Name3-N-(2-chloro-4,6-difluorophenyl)pyrazine-2,3-diamine
SMILESNc1nccnc1Nc1c(F)cc(F)cc1Cl
InChIInChI=1S/C10H7ClF2N4/c11-6-3-5(12)4-7(13)8(6)17-10-9(14)15-1-2-16-10/h1-4H,(H2,14,15)(H,16,17)
InChIKeyRLNBFLRRHXOBGR-UHFFFAOYSA-N
XLogP2.73
TPSA63.83 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.64
LogP ≤ 52.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-chloro-2-N-(2-chloro-4,6-difluorophenyl)pyridine-2,5-diamine
CID 114046291
3-(2-chloro-4,6-difluoroanilino)pyrazine-2-carbonitrile
CID 83087195
N-(2-chloro-4,6-difluorophenyl)-6-hydrazinyl-5-methylpyrimidin-4-amine
CID 83082645
4-N-(2-chloro-4,6-difluorophenyl)-5-ethylpyrimidine-4,6-diamine
CID 83082644
2-chloro-N-(2-chloro-4,6-difluorophenyl)-5-fluoropyrimidin-4-amine
CID 83087621
6-chloro-2-N-(2-chloro-4,6-difluorophenyl)-1,3,5-triazine-2,4-diamine
CID 83083273
N-(2-chloro-4,6-difluorophenyl)-6-hydrazinyl-2,5-dimethylpyrimidin-4-amine
CID 83082819
5-amino-6-(2-chloro-4,6-difluoroanilino)pyridine-3-carboxylic acid
CID 83087906
3-bromo-5-chloro-N-(2-chloro-4,6-difluorophenyl)pyridin-2-amine
CID 114837355
4,5-dichloro-2-N-(2-chloro-4,6-difluorophenyl)benzene-1,2-diamine
CID 83081059
4-N-(2-chloro-4,6-difluorophenyl)-6-propan-2-yloxypyrimidine-4,5-diamine
CID 83072877
N-(2-chloro-4,6-difluorophenyl)-5-ethyl-6-hydrazinylpyrimidin-4-amine
CID 83083447

Frequently Asked Questions

What is the IUPAC name of 3-N-(2-chloro-4,6-difluorophenyl)pyrazine-2,3-diamine?
The IUPAC name of 3-N-(2-chloro-4,6-difluorophenyl)pyrazine-2,3-diamine (CID 102987080) is 3-N-(2-chloro-4,6-difluorophenyl)pyrazine-2,3-diamine.
What is the SMILES notation for 3-N-(2-chloro-4,6-difluorophenyl)pyrazine-2,3-diamine?
The canonical SMILES for 3-N-(2-chloro-4,6-difluorophenyl)pyrazine-2,3-diamine is Nc1nccnc1Nc1c(F)cc(F)cc1Cl.
What is the InChIKey of 3-N-(2-chloro-4,6-difluorophenyl)pyrazine-2,3-diamine?
The InChIKey is RLNBFLRRHXOBGR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H7ClF2N4/c11-6-3-5(12)4-7(13)8(6)17-10-9(14)15-1-2-16-10/h1-4H,(H2,14,15)(H,16,17).
What are the key properties of 3-N-(2-chloro-4,6-difluorophenyl)pyrazine-2,3-diamine?
3-N-(2-chloro-4,6-difluorophenyl)pyrazine-2,3-diamine has a molecular weight of 256.64 g/mol, XLogP of 2.73, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-N-(2-chloro-4,6-difluorophenyl)pyrazine-2,3-diamine is sourced from PubChem (CID 102987080), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).