[2-(4-tert-butylphenyl)-1-(3-chloro-2-pyridinyl)ethyl]hydrazine

C17H22ClN3 — CID 103445951

IUPAC[2-(4-tert-butylphenyl)-1-(3-chloro-2-pyridinyl)ethyl]hydrazine
SMILESCC(C)(C)c1ccc(CC(NN)c2ncccc2Cl)cc1
InChIInChI=1S/C17H22ClN3/c1-17(2,3)13-8-6-12(7-9-13)11-15(21-19)16-14(18)5-4-10-20-16/h4-10,15,21H,11,19H2,1-3H3
InChIKeyOVDIIASJVBHCII-UHFFFAOYSA-N
MW303.84 g/mol
LogP3.78
Rot. Bonds4

About [2-(4-tert-butylphenyl)-1-(3-chloro-2-pyridinyl)ethyl]hydrazine

[2-(4-tert-butylphenyl)-1-(3-chloro-2-pyridinyl)ethyl]hydrazine (PubChem CID 103445951) has the molecular formula C17H22ClN3 and a molecular weight of 303.84 g/mol. Its IUPAC name is [2-(4-tert-butylphenyl)-1-(3-chloro-2-pyridinyl)ethyl]hydrazine.

Molecular Properties

Compound Name[2-(4-tert-butylphenyl)-1-(3-chloro-2-pyridinyl)ethyl]hydrazine
PubChem CID103445951
Molecular FormulaC17H22ClN3
Molecular Weight303.84 g/mol
Exact Mass303.15
IUPAC Name[2-(4-tert-butylphenyl)-1-(3-chloro-2-pyridinyl)ethyl]hydrazine
SMILESCC(C)(C)c1ccc(CC(NN)c2ncccc2Cl)cc1
InChIInChI=1S/C17H22ClN3/c1-17(2,3)13-8-6-12(7-9-13)11-15(21-19)16-14(18)5-4-10-20-16/h4-10,15,21H,11,19H2,1-3H3
InChIKeyOVDIIASJVBHCII-UHFFFAOYSA-N
XLogP3.78
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.84
LogP ≤ 53.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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

1-(3-chloro-2-pyridinyl)butylhydrazine
CID 103445669
[1-(3-chloro-2-pyridinyl)-2-(2,3-dihydro-1H-inden-5-yl)ethyl]hydrazine
CID 103445912
[2-(4-chlorophenyl)-1-(3-methyl-2-pyridinyl)ethyl]hydrazine
CID 105209390
[2-(4-tert-butylphenyl)-1-(3-chloro-4-pyridinyl)ethyl]hydrazine
CID 105296557
3-[2-(3-chloro-2-pyridinyl)-2-hydrazinylethyl]pyridin-2-amine
CID 103445799
[1-(3-chloro-2-pyridinyl)-4-methoxy-4-methylpentyl]hydrazine
CID 103445658
[2-(2-bromophenyl)-1-(3-chloro-2-pyridinyl)ethyl]hydrazine
CID 103445803
[1-(3-chloro-2-pyridinyl)-2-(1-ethylimidazol-2-yl)ethyl]hydrazine
CID 103445832
[2-(4-tert-butylphenyl)-1-pyrazin-2-ylethyl]hydrazine
CID 105203386
[1-(3-bromo-2-pyridinyl)-2-(4-ethylphenyl)ethyl]hydrazine
CID 105267953
2-(4-tert-butylphenyl)-N-methyl-1-pyrimidin-2-ylethanamine
CID 62599855
[1-(3-methyl-2-pyridinyl)-2-pyridin-4-ylethyl]hydrazine
CID 105209330

Frequently Asked Questions

What is the IUPAC name of [2-(4-tert-butylphenyl)-1-(3-chloro-2-pyridinyl)ethyl]hydrazine?
The IUPAC name of [2-(4-tert-butylphenyl)-1-(3-chloro-2-pyridinyl)ethyl]hydrazine (CID 103445951) is [2-(4-tert-butylphenyl)-1-(3-chloro-2-pyridinyl)ethyl]hydrazine.
What is the SMILES notation for [2-(4-tert-butylphenyl)-1-(3-chloro-2-pyridinyl)ethyl]hydrazine?
The canonical SMILES for [2-(4-tert-butylphenyl)-1-(3-chloro-2-pyridinyl)ethyl]hydrazine is CC(C)(C)c1ccc(CC(NN)c2ncccc2Cl)cc1.
What is the InChIKey of [2-(4-tert-butylphenyl)-1-(3-chloro-2-pyridinyl)ethyl]hydrazine?
The InChIKey is OVDIIASJVBHCII-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22ClN3/c1-17(2,3)13-8-6-12(7-9-13)11-15(21-19)16-14(18)5-4-10-20-16/h4-10,15,21H,11,19H2,1-3H3.
What are the key properties of [2-(4-tert-butylphenyl)-1-(3-chloro-2-pyridinyl)ethyl]hydrazine?
[2-(4-tert-butylphenyl)-1-(3-chloro-2-pyridinyl)ethyl]hydrazine has a molecular weight of 303.84 g/mol, XLogP of 3.78, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(4-tert-butylphenyl)-1-(3-chloro-2-pyridinyl)ethyl]hydrazine is sourced from PubChem (CID 103445951), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).