3,5-difluoro-6-hydrazinyl-N-methyl-N-[(3-methylphenyl)methyl]pyridin-2-amine

C14H16F2N4 — CID 114072993

IUPAC3,5-difluoro-6-hydrazinyl-N-methyl-N-[(3-methylphenyl)methyl]pyridin-2-amine
SMILESCc1cccc(CN(C)c2nc(NN)c(F)cc2F)c1
InChIInChI=1S/C14H16F2N4/c1-9-4-3-5-10(6-9)8-20(2)14-12(16)7-11(15)13(18-14)19-17/h3-7H,8,17H2,1-2H3,(H,18,19)
InChIKeyVFQMLKFLYGOSQA-UHFFFAOYSA-N
MW278.31 g/mol
LogP2.59
Rot. Bonds4

About 3,5-difluoro-6-hydrazinyl-N-methyl-N-[(3-methylphenyl)methyl]pyridin-2-amine

3,5-difluoro-6-hydrazinyl-N-methyl-N-[(3-methylphenyl)methyl]pyridin-2-amine (PubChem CID 114072993) has the molecular formula C14H16F2N4 and a molecular weight of 278.31 g/mol. Its IUPAC name is 3,5-difluoro-6-hydrazinyl-N-methyl-N-[(3-methylphenyl)methyl]pyridin-2-amine.

Molecular Properties

Compound Name3,5-difluoro-6-hydrazinyl-N-methyl-N-[(3-methylphenyl)methyl]pyridin-2-amine
PubChem CID114072993
Molecular FormulaC14H16F2N4
Molecular Weight278.31 g/mol
Exact Mass278.13
IUPAC Name3,5-difluoro-6-hydrazinyl-N-methyl-N-[(3-methylphenyl)methyl]pyridin-2-amine
SMILESCc1cccc(CN(C)c2nc(NN)c(F)cc2F)c1
InChIInChI=1S/C14H16F2N4/c1-9-4-3-5-10(6-9)8-20(2)14-12(16)7-11(15)13(18-14)19-17/h3-7H,8,17H2,1-2H3,(H,18,19)
InChIKeyVFQMLKFLYGOSQA-UHFFFAOYSA-N
XLogP2.59
TPSA54.18 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.31
LogP ≤ 52.59
H-Bond Donors ≤ 52
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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Frequently Asked Questions

What is the IUPAC name of 3,5-difluoro-6-hydrazinyl-N-methyl-N-[(3-methylphenyl)methyl]pyridin-2-amine?
The IUPAC name of 3,5-difluoro-6-hydrazinyl-N-methyl-N-[(3-methylphenyl)methyl]pyridin-2-amine (CID 114072993) is 3,5-difluoro-6-hydrazinyl-N-methyl-N-[(3-methylphenyl)methyl]pyridin-2-amine.
What is the SMILES notation for 3,5-difluoro-6-hydrazinyl-N-methyl-N-[(3-methylphenyl)methyl]pyridin-2-amine?
The canonical SMILES for 3,5-difluoro-6-hydrazinyl-N-methyl-N-[(3-methylphenyl)methyl]pyridin-2-amine is Cc1cccc(CN(C)c2nc(NN)c(F)cc2F)c1.
What is the InChIKey of 3,5-difluoro-6-hydrazinyl-N-methyl-N-[(3-methylphenyl)methyl]pyridin-2-amine?
The InChIKey is VFQMLKFLYGOSQA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16F2N4/c1-9-4-3-5-10(6-9)8-20(2)14-12(16)7-11(15)13(18-14)19-17/h3-7H,8,17H2,1-2H3,(H,18,19).
What are the key properties of 3,5-difluoro-6-hydrazinyl-N-methyl-N-[(3-methylphenyl)methyl]pyridin-2-amine?
3,5-difluoro-6-hydrazinyl-N-methyl-N-[(3-methylphenyl)methyl]pyridin-2-amine has a molecular weight of 278.31 g/mol, XLogP of 2.59, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-difluoro-6-hydrazinyl-N-methyl-N-[(3-methylphenyl)methyl]pyridin-2-amine is sourced from PubChem (CID 114072993), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).