3,5-dichloro-6-hydrazinyl-N-(2-phenoxyethyl)pyridin-2-amine

C13H14Cl2N4O — CID 102761875

IUPAC3,5-dichloro-6-hydrazinyl-N-(2-phenoxyethyl)pyridin-2-amine
SMILESNNc1nc(NCCOc2ccccc2)c(Cl)cc1Cl
InChIInChI=1S/C13H14Cl2N4O/c14-10-8-11(15)13(19-16)18-12(10)17-6-7-20-9-4-2-1-3-5-9/h1-5,8H,6-7,16H2,(H2,17,18,19)
InChIKeyJCHDDIYXPNIPPZ-UHFFFAOYSA-N
MW313.19 g/mol
LogP3.16
Rot. Bonds6

About 3,5-dichloro-6-hydrazinyl-N-(2-phenoxyethyl)pyridin-2-amine

3,5-dichloro-6-hydrazinyl-N-(2-phenoxyethyl)pyridin-2-amine (PubChem CID 102761875) has the molecular formula C13H14Cl2N4O and a molecular weight of 313.19 g/mol. Its IUPAC name is 3,5-dichloro-6-hydrazinyl-N-(2-phenoxyethyl)pyridin-2-amine.

Molecular Properties

Compound Name3,5-dichloro-6-hydrazinyl-N-(2-phenoxyethyl)pyridin-2-amine
PubChem CID102761875
Molecular FormulaC13H14Cl2N4O
Molecular Weight313.19 g/mol
Exact Mass312.05
IUPAC Name3,5-dichloro-6-hydrazinyl-N-(2-phenoxyethyl)pyridin-2-amine
SMILESNNc1nc(NCCOc2ccccc2)c(Cl)cc1Cl
InChIInChI=1S/C13H14Cl2N4O/c14-10-8-11(15)13(19-16)18-12(10)17-6-7-20-9-4-2-1-3-5-9/h1-5,8H,6-7,16H2,(H2,17,18,19)
InChIKeyJCHDDIYXPNIPPZ-UHFFFAOYSA-N
XLogP3.16
TPSA72.20 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.19
LogP ≤ 53.16
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

6-hydrazinyl-2,5-dimethyl-N-(2-phenoxyethyl)pyrimidin-4-amine
CID 80900531
3,5-dichloro-6-hydrazinyl-N-(3-phenylbutyl)pyridin-2-amine
CID 102762003
5-chloro-6-(2-phenoxyethylamino)pyridine-3-carbaldehyde
CID 59242463
3,5-dichloro-6-hydrazinyl-N-(4-methoxybutyl)pyridin-2-amine
CID 102761891
4-bromo-2,6-dichloro-N-(2-phenoxyethyl)aniline
CID 63487856
6-hydrazinyl-N-(2-phenoxyethyl)-5-propan-2-ylpyrimidin-4-amine
CID 80902452
6-hydrazinyl-N-(2-phenoxyethyl)pyrimidin-4-amine
CID 80901369
(3,5-dichloro-6-phenylmethoxy-2-pyridinyl)hydrazine
CID 102762715
N-[2-(3-aminophenoxy)ethyl]-5-bromo-3-chloropyridin-2-amine
CID 103582766
6-chloro-4,5-dimethyl-N-(2-phenoxyethyl)pyridazin-3-amine
CID 63271688
4-N-(2-phenoxyethyl)quinazoline-2,4-diamine
CID 80791774
6-chloro-2-(2-phenoxyethylamino)pyridine-3-carboxylic acid
CID 63380096

Frequently Asked Questions

What is the IUPAC name of 3,5-dichloro-6-hydrazinyl-N-(2-phenoxyethyl)pyridin-2-amine?
The IUPAC name of 3,5-dichloro-6-hydrazinyl-N-(2-phenoxyethyl)pyridin-2-amine (CID 102761875) is 3,5-dichloro-6-hydrazinyl-N-(2-phenoxyethyl)pyridin-2-amine.
What is the SMILES notation for 3,5-dichloro-6-hydrazinyl-N-(2-phenoxyethyl)pyridin-2-amine?
The canonical SMILES for 3,5-dichloro-6-hydrazinyl-N-(2-phenoxyethyl)pyridin-2-amine is NNc1nc(NCCOc2ccccc2)c(Cl)cc1Cl.
What is the InChIKey of 3,5-dichloro-6-hydrazinyl-N-(2-phenoxyethyl)pyridin-2-amine?
The InChIKey is JCHDDIYXPNIPPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14Cl2N4O/c14-10-8-11(15)13(19-16)18-12(10)17-6-7-20-9-4-2-1-3-5-9/h1-5,8H,6-7,16H2,(H2,17,18,19).
What are the key properties of 3,5-dichloro-6-hydrazinyl-N-(2-phenoxyethyl)pyridin-2-amine?
3,5-dichloro-6-hydrazinyl-N-(2-phenoxyethyl)pyridin-2-amine has a molecular weight of 313.19 g/mol, XLogP of 3.16, 6 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dichloro-6-hydrazinyl-N-(2-phenoxyethyl)pyridin-2-amine is sourced from PubChem (CID 102761875), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).