5-chloro-3-[2-(3-fluorophenyl)-1-hydrazinylethyl]pyridin-2-amine

C13H14ClFN4 — CID 105204807

IUPAC5-chloro-3-[2-(3-fluorophenyl)-1-hydrazinylethyl]pyridin-2-amine
SMILESNNC(Cc1cccc(F)c1)c1cc(Cl)cnc1N
InChIInChI=1S/C13H14ClFN4/c14-9-6-11(13(16)18-7-9)12(19-17)5-8-2-1-3-10(15)4-8/h1-4,6-7,12,19H,5,17H2,(H2,16,18)
InChIKeyMKHOGAONWOVBEH-UHFFFAOYSA-N
MW280.73 g/mol
LogP2.20
Rot. Bonds4

About 5-chloro-3-[2-(3-fluorophenyl)-1-hydrazinylethyl]pyridin-2-amine

5-chloro-3-[2-(3-fluorophenyl)-1-hydrazinylethyl]pyridin-2-amine (PubChem CID 105204807) has the molecular formula C13H14ClFN4 and a molecular weight of 280.73 g/mol. Its IUPAC name is 5-chloro-3-[2-(3-fluorophenyl)-1-hydrazinylethyl]pyridin-2-amine.

Molecular Properties

Compound Name5-chloro-3-[2-(3-fluorophenyl)-1-hydrazinylethyl]pyridin-2-amine
PubChem CID105204807
Molecular FormulaC13H14ClFN4
Molecular Weight280.73 g/mol
Exact Mass280.09
IUPAC Name5-chloro-3-[2-(3-fluorophenyl)-1-hydrazinylethyl]pyridin-2-amine
SMILESNNC(Cc1cccc(F)c1)c1cc(Cl)cnc1N
InChIInChI=1S/C13H14ClFN4/c14-9-6-11(13(16)18-7-9)12(19-17)5-8-2-1-3-10(15)4-8/h1-4,6-7,12,19H,5,17H2,(H2,16,18)
InChIKeyMKHOGAONWOVBEH-UHFFFAOYSA-N
XLogP2.20
TPSA76.96 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.73
LogP ≤ 52.20
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

5-chloro-3-[1-hydrazinyl-2-(3-methylphenyl)ethyl]pyridin-2-amine
CID 105208981
5-chloro-3-(1-hydrazinyl-2-pyridin-3-ylethyl)pyridin-2-amine
CID 105212191
3-[2-(3-chlorophenyl)-1-hydrazinylethyl]-5-methylpyridin-2-amine
CID 105195089
[1-(2,6-dichlorophenyl)-2-(3-fluorophenyl)ethyl]hydrazine
CID 105286398
3-[2-(3-chlorophenyl)-1-hydrazinylethyl]pyridin-2-amine
CID 105194946
[1-(3-bromo-2-fluorophenyl)-2-(3-fluorophenyl)ethyl]hydrazine
CID 106648688
[1-(2,4-difluoro-5-methylphenyl)-2-(3-fluorophenyl)ethyl]hydrazine
CID 105286436
5-chloro-3-[2-(3-chloro-2-fluorophenyl)-1-(methylamino)ethyl]pyridin-2-amine
CID 82806067
5-chloro-3-(1-hydrazinylpentyl)pyridin-2-amine
CID 105245743
3-[2-(3-chloro-2-fluorophenyl)-1-hydrazinylethyl]-5-methylpyridin-2-amine
CID 105264497
[2-(3,4-dichlorophenyl)-1-(3-fluorophenyl)ethyl]hydrazine
CID 105192922
5-chloro-3-(1-hydrazinyl-3-methoxypropyl)pyridin-2-amine
CID 105206436

Frequently Asked Questions

What is the IUPAC name of 5-chloro-3-[2-(3-fluorophenyl)-1-hydrazinylethyl]pyridin-2-amine?
The IUPAC name of 5-chloro-3-[2-(3-fluorophenyl)-1-hydrazinylethyl]pyridin-2-amine (CID 105204807) is 5-chloro-3-[2-(3-fluorophenyl)-1-hydrazinylethyl]pyridin-2-amine.
What is the SMILES notation for 5-chloro-3-[2-(3-fluorophenyl)-1-hydrazinylethyl]pyridin-2-amine?
The canonical SMILES for 5-chloro-3-[2-(3-fluorophenyl)-1-hydrazinylethyl]pyridin-2-amine is NNC(Cc1cccc(F)c1)c1cc(Cl)cnc1N.
What is the InChIKey of 5-chloro-3-[2-(3-fluorophenyl)-1-hydrazinylethyl]pyridin-2-amine?
The InChIKey is MKHOGAONWOVBEH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14ClFN4/c14-9-6-11(13(16)18-7-9)12(19-17)5-8-2-1-3-10(15)4-8/h1-4,6-7,12,19H,5,17H2,(H2,16,18).
What are the key properties of 5-chloro-3-[2-(3-fluorophenyl)-1-hydrazinylethyl]pyridin-2-amine?
5-chloro-3-[2-(3-fluorophenyl)-1-hydrazinylethyl]pyridin-2-amine has a molecular weight of 280.73 g/mol, XLogP of 2.20, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-3-[2-(3-fluorophenyl)-1-hydrazinylethyl]pyridin-2-amine is sourced from PubChem (CID 105204807), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).