[(4-chlorophenyl)-(1-propylimidazol-2-yl)methyl]hydrazine

C13H17ClN4 — CID 105193319

IUPAC[(4-chlorophenyl)-(1-propylimidazol-2-yl)methyl]hydrazine
SMILESCCCn1ccnc1C(NN)c1ccc(Cl)cc1
InChIInChI=1S/C13H17ClN4/c1-2-8-18-9-7-16-13(18)12(17-15)10-3-5-11(14)6-4-10/h3-7,9,12,17H,2,8,15H2,1H3
InChIKeyITONVZCLBNJIRR-UHFFFAOYSA-N
MW264.76 g/mol
LogP2.50
Rot. Bonds5

About [(4-chlorophenyl)-(1-propylimidazol-2-yl)methyl]hydrazine

[(4-chlorophenyl)-(1-propylimidazol-2-yl)methyl]hydrazine (PubChem CID 105193319) has the molecular formula C13H17ClN4 and a molecular weight of 264.76 g/mol. Its IUPAC name is [(4-chlorophenyl)-(1-propylimidazol-2-yl)methyl]hydrazine.

Molecular Properties

Compound Name[(4-chlorophenyl)-(1-propylimidazol-2-yl)methyl]hydrazine
PubChem CID105193319
Molecular FormulaC13H17ClN4
Molecular Weight264.76 g/mol
Exact Mass264.11
IUPAC Name[(4-chlorophenyl)-(1-propylimidazol-2-yl)methyl]hydrazine
SMILESCCCn1ccnc1C(NN)c1ccc(Cl)cc1
InChIInChI=1S/C13H17ClN4/c1-2-8-18-9-7-16-13(18)12(17-15)10-3-5-11(14)6-4-10/h3-7,9,12,17H,2,8,15H2,1H3
InChIKeyITONVZCLBNJIRR-UHFFFAOYSA-N
XLogP2.50
TPSA55.87 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.76
LogP ≤ 52.50
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

N-[(4-chlorophenyl)-(1-propylimidazol-2-yl)methyl]propan-1-amine
CID 61318759
[(1-propylimidazol-2-yl)-[4-(trifluoromethyl)phenyl]methyl]hydrazine
CID 105307552
[(2-chloro-3-fluorophenyl)-(1-propylimidazol-2-yl)methyl]hydrazine
CID 105307653
1-(4-chlorophenyl)-1-(1-ethylimidazol-2-yl)-N-methylmethanamine
CID 61316350
[(3-bromophenyl)-(1-propylimidazol-2-yl)methyl]hydrazine
CID 105197993
[(2,5-difluorophenyl)-(1-propylimidazol-2-yl)methyl]hydrazine
CID 105219387
[(2-methylpyrazol-3-yl)-(1-propylimidazol-2-yl)methyl]hydrazine
CID 105307580
[(3-fluoro-2-pyridinyl)-(1-propylimidazol-2-yl)methyl]hydrazine
CID 105257823
N-[(4-chloro-3-fluorophenyl)-(1-propylimidazol-2-yl)methyl]propan-1-amine
CID 107992682
N-[(2,4-dichlorophenyl)-(1-propylimidazol-2-yl)methyl]propan-1-amine
CID 61319386
N-methyl-1-(4-methylsulfanylphenyl)-1-(1-propylimidazol-2-yl)methanamine
CID 79206742
[(3-chloro-5-methylphenyl)-(1-ethylimidazol-2-yl)methyl]hydrazine
CID 105308375

Frequently Asked Questions

What is the IUPAC name of [(4-chlorophenyl)-(1-propylimidazol-2-yl)methyl]hydrazine?
The IUPAC name of [(4-chlorophenyl)-(1-propylimidazol-2-yl)methyl]hydrazine (CID 105193319) is [(4-chlorophenyl)-(1-propylimidazol-2-yl)methyl]hydrazine.
What is the SMILES notation for [(4-chlorophenyl)-(1-propylimidazol-2-yl)methyl]hydrazine?
The canonical SMILES for [(4-chlorophenyl)-(1-propylimidazol-2-yl)methyl]hydrazine is CCCn1ccnc1C(NN)c1ccc(Cl)cc1.
What is the InChIKey of [(4-chlorophenyl)-(1-propylimidazol-2-yl)methyl]hydrazine?
The InChIKey is ITONVZCLBNJIRR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17ClN4/c1-2-8-18-9-7-16-13(18)12(17-15)10-3-5-11(14)6-4-10/h3-7,9,12,17H,2,8,15H2,1H3.
What are the key properties of [(4-chlorophenyl)-(1-propylimidazol-2-yl)methyl]hydrazine?
[(4-chlorophenyl)-(1-propylimidazol-2-yl)methyl]hydrazine has a molecular weight of 264.76 g/mol, XLogP of 2.50, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [(4-chlorophenyl)-(1-propylimidazol-2-yl)methyl]hydrazine is sourced from PubChem (CID 105193319), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).