3,5-dichloro-N-[2-(4-fluoro-2-methylphenyl)ethyl]-6-hydrazinylpyridin-2-amine

C14H15Cl2FN4 — CID 102762299

IUPAC3,5-dichloro-N-[2-(4-fluoro-2-methylphenyl)ethyl]-6-hydrazinylpyridin-2-amine
SMILESCc1cc(F)ccc1CCNc1nc(NN)c(Cl)cc1Cl
InChIInChI=1S/C14H15Cl2FN4/c1-8-6-10(17)3-2-9(8)4-5-19-13-11(15)7-12(16)14(20-13)21-18/h2-3,6-7H,4-5,18H2,1H3,(H2,19,20,21)
InChIKeyVYQCWSSAQXYVRJ-UHFFFAOYSA-N
MW329.21 g/mol
LogP3.78
Rot. Bonds5

About 3,5-dichloro-N-[2-(4-fluoro-2-methylphenyl)ethyl]-6-hydrazinylpyridin-2-amine

3,5-dichloro-N-[2-(4-fluoro-2-methylphenyl)ethyl]-6-hydrazinylpyridin-2-amine (PubChem CID 102762299) has the molecular formula C14H15Cl2FN4 and a molecular weight of 329.21 g/mol. Its IUPAC name is 3,5-dichloro-N-[2-(4-fluoro-2-methylphenyl)ethyl]-6-hydrazinylpyridin-2-amine.

Molecular Properties

Compound Name3,5-dichloro-N-[2-(4-fluoro-2-methylphenyl)ethyl]-6-hydrazinylpyridin-2-amine
PubChem CID102762299
Molecular FormulaC14H15Cl2FN4
Molecular Weight329.21 g/mol
Exact Mass328.07
IUPAC Name3,5-dichloro-N-[2-(4-fluoro-2-methylphenyl)ethyl]-6-hydrazinylpyridin-2-amine
SMILESCc1cc(F)ccc1CCNc1nc(NN)c(Cl)cc1Cl
InChIInChI=1S/C14H15Cl2FN4/c1-8-6-10(17)3-2-9(8)4-5-19-13-11(15)7-12(16)14(20-13)21-18/h2-3,6-7H,4-5,18H2,1H3,(H2,19,20,21)
InChIKeyVYQCWSSAQXYVRJ-UHFFFAOYSA-N
XLogP3.78
TPSA62.97 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.21
LogP ≤ 53.78
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'}

Analyze 3,5-dichloro-N-[2-(4-fluoro-2-methylphenyl)ethyl]-6-hydrazinylpyridin-2-amine 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

N-[2-(4-fluoro-2-methylphenyl)ethyl]-6-hydrazinyl-2-methylpyrimidin-4-amine
CID 80926608
4-N-[2-(4-fluoro-2-methylphenyl)ethyl]-2,5-dimethylpyrimidine-4,6-diamine
CID 80852310
2-(4-fluoro-2-methylphenyl)ethylhydrazine
CID 105220815
N-(3,5-dichloro-6-hydrazinyl-2-pyridinyl)-N',N'-dimethylethane-1,2-diamine
CID 102762401
3,5-dichloro-6-hydrazinyl-N-[2-(4-methoxyphenyl)ethyl]pyridin-2-amine
CID 102762415
4-N-[2-(4-fluoro-2-methylphenyl)ethyl]-2-methylpyrimidine-4,6-diamine
CID 80852017
3,5-dichloro-6-hydrazinyl-N-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]pyridin-2-amine
CID 106424765
4-N-[2-(4-fluoro-2-methylphenyl)ethyl]-2-methylsulfanylpyrimidine-4,6-diamine
CID 80852616
3-bromo-2-N-[2-(4-fluoro-2-methylphenyl)ethyl]-4-methylpyridine-2,5-diamine
CID 104507040
1-cyclopropyl-N-[2-(4-fluoro-2-methylphenyl)ethyl]-4-methylimidazol-2-amine
CID 106576890
4-N-[2-(4-fluoro-2-methylphenyl)ethyl]-2-propylpyrimidine-4,6-diamine
CID 80944222
4-cyclopropyl-5-N-[2-(4-fluoro-2-methylphenyl)ethyl]-1,2-thiazole-3,5-diamine
CID 103364521

Frequently Asked Questions

What is the IUPAC name of 3,5-dichloro-N-[2-(4-fluoro-2-methylphenyl)ethyl]-6-hydrazinylpyridin-2-amine?
The IUPAC name of 3,5-dichloro-N-[2-(4-fluoro-2-methylphenyl)ethyl]-6-hydrazinylpyridin-2-amine (CID 102762299) is 3,5-dichloro-N-[2-(4-fluoro-2-methylphenyl)ethyl]-6-hydrazinylpyridin-2-amine.
What is the SMILES notation for 3,5-dichloro-N-[2-(4-fluoro-2-methylphenyl)ethyl]-6-hydrazinylpyridin-2-amine?
The canonical SMILES for 3,5-dichloro-N-[2-(4-fluoro-2-methylphenyl)ethyl]-6-hydrazinylpyridin-2-amine is Cc1cc(F)ccc1CCNc1nc(NN)c(Cl)cc1Cl.
What is the InChIKey of 3,5-dichloro-N-[2-(4-fluoro-2-methylphenyl)ethyl]-6-hydrazinylpyridin-2-amine?
The InChIKey is VYQCWSSAQXYVRJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15Cl2FN4/c1-8-6-10(17)3-2-9(8)4-5-19-13-11(15)7-12(16)14(20-13)21-18/h2-3,6-7H,4-5,18H2,1H3,(H2,19,20,21).
What are the key properties of 3,5-dichloro-N-[2-(4-fluoro-2-methylphenyl)ethyl]-6-hydrazinylpyridin-2-amine?
3,5-dichloro-N-[2-(4-fluoro-2-methylphenyl)ethyl]-6-hydrazinylpyridin-2-amine has a molecular weight of 329.21 g/mol, XLogP of 3.78, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dichloro-N-[2-(4-fluoro-2-methylphenyl)ethyl]-6-hydrazinylpyridin-2-amine is sourced from PubChem (CID 102762299), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).