[2-(3-chloro-2-fluorophenyl)-1-(1-propylimidazol-2-yl)ethyl]hydrazine

C14H18ClFN4 — CID 105264382

IUPAC[2-(3-chloro-2-fluorophenyl)-1-(1-propylimidazol-2-yl)ethyl]hydrazine
SMILESCCCn1ccnc1C(Cc1cccc(Cl)c1F)NN
InChIInChI=1S/C14H18ClFN4/c1-2-7-20-8-6-18-14(20)12(19-17)9-10-4-3-5-11(15)13(10)16/h3-6,8,12,19H,2,7,9,17H2,1H3
InChIKeyDZGWDGQQBSYLDO-UHFFFAOYSA-N
MW296.78 g/mol
LogP2.83
Rot. Bonds6

About [2-(3-chloro-2-fluorophenyl)-1-(1-propylimidazol-2-yl)ethyl]hydrazine

[2-(3-chloro-2-fluorophenyl)-1-(1-propylimidazol-2-yl)ethyl]hydrazine (PubChem CID 105264382) has the molecular formula C14H18ClFN4 and a molecular weight of 296.78 g/mol. Its IUPAC name is [2-(3-chloro-2-fluorophenyl)-1-(1-propylimidazol-2-yl)ethyl]hydrazine.

Molecular Properties

Compound Name[2-(3-chloro-2-fluorophenyl)-1-(1-propylimidazol-2-yl)ethyl]hydrazine
PubChem CID105264382
Molecular FormulaC14H18ClFN4
Molecular Weight296.78 g/mol
Exact Mass296.12
IUPAC Name[2-(3-chloro-2-fluorophenyl)-1-(1-propylimidazol-2-yl)ethyl]hydrazine
SMILESCCCn1ccnc1C(Cc1cccc(Cl)c1F)NN
InChIInChI=1S/C14H18ClFN4/c1-2-7-20-8-6-18-14(20)12(19-17)9-10-4-3-5-11(15)13(10)16/h3-6,8,12,19H,2,7,9,17H2,1H3
InChIKeyDZGWDGQQBSYLDO-UHFFFAOYSA-N
XLogP2.83
TPSA55.87 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.78
LogP ≤ 52.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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

2-(3-chloro-2-fluorophenyl)-1-(1-propylimidazol-2-yl)ethanamine
CID 82805348
2-(2-fluorophenyl)-N-methyl-1-(1-propylimidazol-2-yl)ethanamine
CID 63970219
[1-(1-propylimidazol-2-yl)-2-pyridin-3-ylethyl]hydrazine
CID 105212135
[(2-chloro-3-fluorophenyl)-(1-propylimidazol-2-yl)methyl]hydrazine
CID 105307653
[1-(2-chlorophenyl)-2-(1-propylimidazol-2-yl)ethyl]hydrazine
CID 105211188
[4-chloro-1-(1-propylimidazol-2-yl)butyl]hydrazine
CID 105235627
[2-methylsulfanyl-1-(1-propylimidazol-2-yl)ethyl]hydrazine
CID 105213893
N-[[1-[(3-chloro-2-fluorophenyl)methyl]imidazol-2-yl]methyl]ethanamine
CID 102856727
[2-methoxy-1-(1-propylimidazol-2-yl)ethyl]hydrazine
CID 105207224
[3,3-dimethyl-1-(1-propylimidazol-2-yl)butyl]hydrazine
CID 105220315
4-[2-(3-chloro-2-fluorophenyl)-1-hydrazinylethyl]-1-methylpyrazol-5-amine
CID 102867831
[1-(2-chloro-6-fluorophenyl)-3-(1-propylimidazol-2-yl)propan-2-yl]hydrazine
CID 105216048

Frequently Asked Questions

What is the IUPAC name of [2-(3-chloro-2-fluorophenyl)-1-(1-propylimidazol-2-yl)ethyl]hydrazine?
The IUPAC name of [2-(3-chloro-2-fluorophenyl)-1-(1-propylimidazol-2-yl)ethyl]hydrazine (CID 105264382) is [2-(3-chloro-2-fluorophenyl)-1-(1-propylimidazol-2-yl)ethyl]hydrazine.
What is the SMILES notation for [2-(3-chloro-2-fluorophenyl)-1-(1-propylimidazol-2-yl)ethyl]hydrazine?
The canonical SMILES for [2-(3-chloro-2-fluorophenyl)-1-(1-propylimidazol-2-yl)ethyl]hydrazine is CCCn1ccnc1C(Cc1cccc(Cl)c1F)NN.
What is the InChIKey of [2-(3-chloro-2-fluorophenyl)-1-(1-propylimidazol-2-yl)ethyl]hydrazine?
The InChIKey is DZGWDGQQBSYLDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18ClFN4/c1-2-7-20-8-6-18-14(20)12(19-17)9-10-4-3-5-11(15)13(10)16/h3-6,8,12,19H,2,7,9,17H2,1H3.
What are the key properties of [2-(3-chloro-2-fluorophenyl)-1-(1-propylimidazol-2-yl)ethyl]hydrazine?
[2-(3-chloro-2-fluorophenyl)-1-(1-propylimidazol-2-yl)ethyl]hydrazine has a molecular weight of 296.78 g/mol, XLogP of 2.83, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(3-chloro-2-fluorophenyl)-1-(1-propylimidazol-2-yl)ethyl]hydrazine is sourced from PubChem (CID 105264382), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).