[1-(3-chloro-2-pyridinyl)-2-(1-ethylimidazol-2-yl)ethyl]hydrazine

C12H16ClN5 — CID 103445832

IUPAC[1-(3-chloro-2-pyridinyl)-2-(1-ethylimidazol-2-yl)ethyl]hydrazine
SMILESCCn1ccnc1CC(NN)c1ncccc1Cl
InChIInChI=1S/C12H16ClN5/c1-2-18-7-6-15-11(18)8-10(17-14)12-9(13)4-3-5-16-12/h3-7,10,17H,2,8,14H2,1H3
InChIKeyATNWXJFHDDWSPW-UHFFFAOYSA-N
MW265.75 g/mol
LogP1.70
Rot. Bonds5

About [1-(3-chloro-2-pyridinyl)-2-(1-ethylimidazol-2-yl)ethyl]hydrazine

[1-(3-chloro-2-pyridinyl)-2-(1-ethylimidazol-2-yl)ethyl]hydrazine (PubChem CID 103445832) has the molecular formula C12H16ClN5 and a molecular weight of 265.75 g/mol. Its IUPAC name is [1-(3-chloro-2-pyridinyl)-2-(1-ethylimidazol-2-yl)ethyl]hydrazine.

Molecular Properties

Compound Name[1-(3-chloro-2-pyridinyl)-2-(1-ethylimidazol-2-yl)ethyl]hydrazine
PubChem CID103445832
Molecular FormulaC12H16ClN5
Molecular Weight265.75 g/mol
Exact Mass265.11
IUPAC Name[1-(3-chloro-2-pyridinyl)-2-(1-ethylimidazol-2-yl)ethyl]hydrazine
SMILESCCn1ccnc1CC(NN)c1ncccc1Cl
InChIInChI=1S/C12H16ClN5/c1-2-18-7-6-15-11(18)8-10(17-14)12-9(13)4-3-5-16-12/h3-7,10,17H,2,8,14H2,1H3
InChIKeyATNWXJFHDDWSPW-UHFFFAOYSA-N
XLogP1.70
TPSA68.76 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.75
LogP ≤ 51.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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

N-[1-(3-chloro-2-pyridinyl)-2-(1-ethylimidazol-2-yl)ethyl]propan-1-amine
CID 103444803
1-(3-chloro-2-pyridinyl)butylhydrazine
CID 103445669
[1-(6-chloro-3-pyridinyl)-2-(1-ethylimidazol-2-yl)ethyl]hydrazine
CID 105253214
2-(1-ethylimidazol-2-yl)-1-(3-methyl-2-pyridinyl)ethanamine
CID 79751489
[1-(2-chlorofuran-3-yl)-2-(1-ethylimidazol-2-yl)ethyl]hydrazine
CID 106694577
[1-(2-chlorophenyl)-2-(1-propylimidazol-2-yl)ethyl]hydrazine
CID 105211188
[1-(3-chloro-2-pyridinyl)-2-(1-methylbenzimidazol-2-yl)ethyl]hydrazine
CID 103445919
[2-(1-ethylimidazol-2-yl)-1-(4-fluorophenyl)ethyl]hydrazine
CID 105192874
[1-(2-ethoxyphenyl)-2-(1-ethylimidazol-2-yl)ethyl]hydrazine
CID 105260835
[2-(1-ethylimidazol-2-yl)-1-naphthalen-1-ylethyl]hydrazine
CID 105213300
3-[2-(3-chloro-2-pyridinyl)-2-hydrazinylethyl]pyridin-2-amine
CID 103445799
[2-(4-tert-butylphenyl)-1-(3-chloro-2-pyridinyl)ethyl]hydrazine
CID 103445951

Frequently Asked Questions

What is the IUPAC name of [1-(3-chloro-2-pyridinyl)-2-(1-ethylimidazol-2-yl)ethyl]hydrazine?
The IUPAC name of [1-(3-chloro-2-pyridinyl)-2-(1-ethylimidazol-2-yl)ethyl]hydrazine (CID 103445832) is [1-(3-chloro-2-pyridinyl)-2-(1-ethylimidazol-2-yl)ethyl]hydrazine.
What is the SMILES notation for [1-(3-chloro-2-pyridinyl)-2-(1-ethylimidazol-2-yl)ethyl]hydrazine?
The canonical SMILES for [1-(3-chloro-2-pyridinyl)-2-(1-ethylimidazol-2-yl)ethyl]hydrazine is CCn1ccnc1CC(NN)c1ncccc1Cl.
What is the InChIKey of [1-(3-chloro-2-pyridinyl)-2-(1-ethylimidazol-2-yl)ethyl]hydrazine?
The InChIKey is ATNWXJFHDDWSPW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16ClN5/c1-2-18-7-6-15-11(18)8-10(17-14)12-9(13)4-3-5-16-12/h3-7,10,17H,2,8,14H2,1H3.
What are the key properties of [1-(3-chloro-2-pyridinyl)-2-(1-ethylimidazol-2-yl)ethyl]hydrazine?
[1-(3-chloro-2-pyridinyl)-2-(1-ethylimidazol-2-yl)ethyl]hydrazine has a molecular weight of 265.75 g/mol, XLogP of 1.70, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(3-chloro-2-pyridinyl)-2-(1-ethylimidazol-2-yl)ethyl]hydrazine is sourced from PubChem (CID 103445832), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).