3,5-dichloro-N-ethyl-6-(4-iodopyrazol-1-yl)pyridin-2-amine

C10H9Cl2IN4 — CID 102760304

IUPAC3,5-dichloro-N-ethyl-6-(4-iodopyrazol-1-yl)pyridin-2-amine
SMILESCCNc1nc(-n2cc(I)cn2)c(Cl)cc1Cl
InChIInChI=1S/C10H9Cl2IN4/c1-2-14-9-7(11)3-8(12)10(16-9)17-5-6(13)4-15-17/h3-5H,2H2,1H3,(H,14,16)
InChIKeyJGPLJMPDAUFPRV-UHFFFAOYSA-N
MW383.02 g/mol
LogP3.61
Rot. Bonds3

About 3,5-dichloro-N-ethyl-6-(4-iodopyrazol-1-yl)pyridin-2-amine

3,5-dichloro-N-ethyl-6-(4-iodopyrazol-1-yl)pyridin-2-amine (PubChem CID 102760304) has the molecular formula C10H9Cl2IN4 and a molecular weight of 383.02 g/mol. Its IUPAC name is 3,5-dichloro-N-ethyl-6-(4-iodopyrazol-1-yl)pyridin-2-amine.

Molecular Properties

Compound Name3,5-dichloro-N-ethyl-6-(4-iodopyrazol-1-yl)pyridin-2-amine
PubChem CID102760304
Molecular FormulaC10H9Cl2IN4
Molecular Weight383.02 g/mol
Exact Mass381.92
IUPAC Name3,5-dichloro-N-ethyl-6-(4-iodopyrazol-1-yl)pyridin-2-amine
SMILESCCNc1nc(-n2cc(I)cn2)c(Cl)cc1Cl
InChIInChI=1S/C10H9Cl2IN4/c1-2-14-9-7(11)3-8(12)10(16-9)17-5-6(13)4-15-17/h3-5H,2H2,1H3,(H,14,16)
InChIKeyJGPLJMPDAUFPRV-UHFFFAOYSA-N
XLogP3.61
TPSA42.74 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500383.02
LogP ≤ 53.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'iodine', 'substructure': 'N/A'}

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Related Compounds

3,5-dichloro-N-ethyl-6-(1,2,4-triazol-1-yl)pyridin-2-amine
CID 102760227
3,5,6-trichloro-N-ethylpyridin-2-amine
CID 102750177
3,5-dichloro-N-ethyl-6-morpholin-4-ylpyridin-2-amine
CID 102755300
6-(benzimidazol-1-yl)-3,5-dichloro-N-ethylpyridin-2-amine
CID 102760242
3,5-dichloro-N-ethyl-6-(1-methylpyrazol-4-yl)pyridin-2-amine
CID 102753146
3,5-dichloro-6-(4-methoxypyrazol-1-yl)-N-methylpyridin-2-amine
CID 114274024
3,5-dichloro-N-ethyl-6-methylpyridin-2-amine
CID 102753093
6-(3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl)-3,5-dichloro-N-ethylpyridin-2-amine
CID 102759337
3,5-dichloro-6-N-ethylpyridine-2,6-diamine
CID 102755516
4-[3,5-dichloro-6-(ethylamino)-2-pyridinyl]piperazin-2-one
CID 102755342
3,5-dichloro-6-N-(2-chloro-4-iodophenyl)-2-N-ethylpyridine-2,6-diamine
CID 107604767
3,5-dichloro-N-ethyl-6-(4-methoxypiperidin-1-yl)pyridin-2-amine
CID 102755942

Frequently Asked Questions

What is the IUPAC name of 3,5-dichloro-N-ethyl-6-(4-iodopyrazol-1-yl)pyridin-2-amine?
The IUPAC name of 3,5-dichloro-N-ethyl-6-(4-iodopyrazol-1-yl)pyridin-2-amine (CID 102760304) is 3,5-dichloro-N-ethyl-6-(4-iodopyrazol-1-yl)pyridin-2-amine.
What is the SMILES notation for 3,5-dichloro-N-ethyl-6-(4-iodopyrazol-1-yl)pyridin-2-amine?
The canonical SMILES for 3,5-dichloro-N-ethyl-6-(4-iodopyrazol-1-yl)pyridin-2-amine is CCNc1nc(-n2cc(I)cn2)c(Cl)cc1Cl.
What is the InChIKey of 3,5-dichloro-N-ethyl-6-(4-iodopyrazol-1-yl)pyridin-2-amine?
The InChIKey is JGPLJMPDAUFPRV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9Cl2IN4/c1-2-14-9-7(11)3-8(12)10(16-9)17-5-6(13)4-15-17/h3-5H,2H2,1H3,(H,14,16).
What are the key properties of 3,5-dichloro-N-ethyl-6-(4-iodopyrazol-1-yl)pyridin-2-amine?
3,5-dichloro-N-ethyl-6-(4-iodopyrazol-1-yl)pyridin-2-amine has a molecular weight of 383.02 g/mol, XLogP of 3.61, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dichloro-N-ethyl-6-(4-iodopyrazol-1-yl)pyridin-2-amine is sourced from PubChem (CID 102760304), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).