ethyl 2-[(6-amino-3,5-dichloro-2-pyridinyl)amino]acetate

C9H11Cl2N3O2 — CID 102756332

IUPACethyl 2-[(6-amino-3,5-dichloro-2-pyridinyl)amino]acetate
SMILESCCOC(=O)CNc1nc(N)c(Cl)cc1Cl
InChIInChI=1S/C9H11Cl2N3O2/c1-2-16-7(15)4-13-9-6(11)3-5(10)8(12)14-9/h3H,2,4H2,1H3,(H3,12,13,14)
InChIKeyZXQXYKDABQONOE-UHFFFAOYSA-N
MW264.11 g/mol
LogP1.95
Rot. Bonds4

About ethyl 2-[(6-amino-3,5-dichloro-2-pyridinyl)amino]acetate

ethyl 2-[(6-amino-3,5-dichloro-2-pyridinyl)amino]acetate (PubChem CID 102756332) has the molecular formula C9H11Cl2N3O2 and a molecular weight of 264.11 g/mol. Its IUPAC name is ethyl 2-[(6-amino-3,5-dichloro-2-pyridinyl)amino]acetate.

Molecular Properties

Compound Nameethyl 2-[(6-amino-3,5-dichloro-2-pyridinyl)amino]acetate
PubChem CID102756332
Molecular FormulaC9H11Cl2N3O2
Molecular Weight264.11 g/mol
Exact Mass263.02
IUPAC Nameethyl 2-[(6-amino-3,5-dichloro-2-pyridinyl)amino]acetate
SMILESCCOC(=O)CNc1nc(N)c(Cl)cc1Cl
InChIInChI=1S/C9H11Cl2N3O2/c1-2-16-7(15)4-13-9-6(11)3-5(10)8(12)14-9/h3H,2,4H2,1H3,(H3,12,13,14)
InChIKeyZXQXYKDABQONOE-UHFFFAOYSA-N
XLogP1.95
TPSA77.24 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.11
LogP ≤ 51.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

ethyl 2-[(3,5-dichloro-6-hydrazinyl-2-pyridinyl)amino]acetate
CID 102761686
ethyl 2-[(3,5-dichloro-2-pyridinyl)amino]acetate
CID 60811106
3,5-dichloro-6-N-ethylpyridine-2,6-diamine
CID 102755516
ethyl 2-[(6-amino-2,5-dimethylpyrimidin-4-yl)amino]acetate
CID 80789883
ethyl 2-[(6-chloro-3-nitro-2-pyridinyl)amino]acetate
CID 15617221
ethyl 2-[(5-amino-2-methyl-1H-imidazol-4-yl)amino]acetate
CID 114995528
3-[(6-amino-3,5-dichloro-2-pyridinyl)amino]-N-propan-2-ylpropanamide
CID 102759699
ethyl 2-(2-chloro-5-methylanilino)acetate
CID 103768009
1-[(6-amino-3,5-dichloro-2-pyridinyl)amino]-2-methyl-3-methylsulfanylpropan-2-ol
CID 106248982
ethyl 2-(2-amino-4-chloro-5-fluoroanilino)acetate
CID 66079161
2-[(3,5-dichloro-6-hydrazinyl-2-pyridinyl)amino]-N,N-diethylacetamide
CID 102762537
ethyl 2-[(2-amino-6-methoxy-5-methyl-3-pyridinyl)amino]acetate
CID 139502832

Frequently Asked Questions

What is the IUPAC name of ethyl 2-[(6-amino-3,5-dichloro-2-pyridinyl)amino]acetate?
The IUPAC name of ethyl 2-[(6-amino-3,5-dichloro-2-pyridinyl)amino]acetate (CID 102756332) is ethyl 2-[(6-amino-3,5-dichloro-2-pyridinyl)amino]acetate.
What is the SMILES notation for ethyl 2-[(6-amino-3,5-dichloro-2-pyridinyl)amino]acetate?
The canonical SMILES for ethyl 2-[(6-amino-3,5-dichloro-2-pyridinyl)amino]acetate is CCOC(=O)CNc1nc(N)c(Cl)cc1Cl.
What is the InChIKey of ethyl 2-[(6-amino-3,5-dichloro-2-pyridinyl)amino]acetate?
The InChIKey is ZXQXYKDABQONOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11Cl2N3O2/c1-2-16-7(15)4-13-9-6(11)3-5(10)8(12)14-9/h3H,2,4H2,1H3,(H3,12,13,14).
What are the key properties of ethyl 2-[(6-amino-3,5-dichloro-2-pyridinyl)amino]acetate?
ethyl 2-[(6-amino-3,5-dichloro-2-pyridinyl)amino]acetate has a molecular weight of 264.11 g/mol, XLogP of 1.95, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 2-[(6-amino-3,5-dichloro-2-pyridinyl)amino]acetate is sourced from PubChem (CID 102756332), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).