[(4-chloro-1-propan-2-ylpyrazol-5-yl)-(2,3-dihydro-1H-inden-1-yl)methyl]hydrazine

C16H21ClN4 — CID 105234528

IUPAC[(4-chloro-1-propan-2-ylpyrazol-5-yl)-(2,3-dihydro-1H-inden-1-yl)methyl]hydrazine
SMILESCC(C)n1ncc(Cl)c1C(NN)C1CCc2ccccc21
InChIInChI=1S/C16H21ClN4/c1-10(2)21-16(14(17)9-19-21)15(20-18)13-8-7-11-5-3-4-6-12(11)13/h3-6,9-10,13,15,20H,7-8,18H2,1-2H3
InChIKeyKZZDSCDEWHJWCZ-UHFFFAOYSA-N
MW304.83 g/mol
LogP3.35
Rot. Bonds4

About [(4-chloro-1-propan-2-ylpyrazol-5-yl)-(2,3-dihydro-1H-inden-1-yl)methyl]hydrazine

[(4-chloro-1-propan-2-ylpyrazol-5-yl)-(2,3-dihydro-1H-inden-1-yl)methyl]hydrazine (PubChem CID 105234528) has the molecular formula C16H21ClN4 and a molecular weight of 304.83 g/mol. Its IUPAC name is [(4-chloro-1-propan-2-ylpyrazol-5-yl)-(2,3-dihydro-1H-inden-1-yl)methyl]hydrazine.

Molecular Properties

Compound Name[(4-chloro-1-propan-2-ylpyrazol-5-yl)-(2,3-dihydro-1H-inden-1-yl)methyl]hydrazine
PubChem CID105234528
Molecular FormulaC16H21ClN4
Molecular Weight304.83 g/mol
Exact Mass304.15
IUPAC Name[(4-chloro-1-propan-2-ylpyrazol-5-yl)-(2,3-dihydro-1H-inden-1-yl)methyl]hydrazine
SMILESCC(C)n1ncc(Cl)c1C(NN)C1CCc2ccccc21
InChIInChI=1S/C16H21ClN4/c1-10(2)21-16(14(17)9-19-21)15(20-18)13-8-7-11-5-3-4-6-12(11)13/h3-6,9-10,13,15,20H,7-8,18H2,1-2H3
InChIKeyKZZDSCDEWHJWCZ-UHFFFAOYSA-N
XLogP3.35
TPSA55.87 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.83
LogP ≤ 53.35
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

[7-bicyclo[4.2.0]octa-1,3,5-trienyl-(4-methoxy-1-propan-2-ylpyrazol-5-yl)methyl]hydrazine
CID 105224746
[(4-chloro-1-propan-2-ylpyrazol-5-yl)-cyclohexylmethyl]hydrazine
CID 105201958
[2,3-dihydro-1H-inden-1-yl-(4-propan-2-ylphenyl)methyl]hydrazine
CID 105234537
[(4-chloro-1-propan-2-ylpyrazol-5-yl)-(5-methyloxolan-2-yl)methyl]hydrazine
CID 105336884
[(4-chloro-1-propan-2-ylpyrazol-5-yl)-(thiolan-2-yl)methyl]hydrazine
CID 105255597
[(4-chloro-1-propan-2-ylpyrazol-5-yl)-(4-propan-2-ylmorpholin-2-yl)methyl]hydrazine
CID 105248212
1-(2-chlorophenyl)-1-(2,3-dihydro-1H-inden-1-yl)-N-methylmethanamine
CID 65403390
1-(4-chloro-1-propan-2-ylpyrazol-5-yl)-N-methyl-1-(4-propan-2-ylcyclohexyl)methanamine
CID 114655530
[2,3-dihydro-1H-inden-1-yl-(2,4,5-trimethylphenyl)methyl]hydrazine
CID 105234484
[3,4,6,7,8,8a-hexahydro-1H-pyrrolo[2,1-c][1,4]oxazin-3-yl-(4-chloro-1-propan-2-ylpyrazol-5-yl)methyl]hydrazine
CID 105245184
[(4-chloro-1-propan-2-ylpyrazol-5-yl)-(2-iodophenyl)methyl]hydrazine
CID 105336809
1-(2,3-dichlorophenyl)-1-(2,3-dihydro-1H-inden-1-yl)-N-methylmethanamine
CID 65406109

Frequently Asked Questions

What is the IUPAC name of [(4-chloro-1-propan-2-ylpyrazol-5-yl)-(2,3-dihydro-1H-inden-1-yl)methyl]hydrazine?
The IUPAC name of [(4-chloro-1-propan-2-ylpyrazol-5-yl)-(2,3-dihydro-1H-inden-1-yl)methyl]hydrazine (CID 105234528) is [(4-chloro-1-propan-2-ylpyrazol-5-yl)-(2,3-dihydro-1H-inden-1-yl)methyl]hydrazine.
What is the SMILES notation for [(4-chloro-1-propan-2-ylpyrazol-5-yl)-(2,3-dihydro-1H-inden-1-yl)methyl]hydrazine?
The canonical SMILES for [(4-chloro-1-propan-2-ylpyrazol-5-yl)-(2,3-dihydro-1H-inden-1-yl)methyl]hydrazine is CC(C)n1ncc(Cl)c1C(NN)C1CCc2ccccc21.
What is the InChIKey of [(4-chloro-1-propan-2-ylpyrazol-5-yl)-(2,3-dihydro-1H-inden-1-yl)methyl]hydrazine?
The InChIKey is KZZDSCDEWHJWCZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21ClN4/c1-10(2)21-16(14(17)9-19-21)15(20-18)13-8-7-11-5-3-4-6-12(11)13/h3-6,9-10,13,15,20H,7-8,18H2,1-2H3.
What are the key properties of [(4-chloro-1-propan-2-ylpyrazol-5-yl)-(2,3-dihydro-1H-inden-1-yl)methyl]hydrazine?
[(4-chloro-1-propan-2-ylpyrazol-5-yl)-(2,3-dihydro-1H-inden-1-yl)methyl]hydrazine has a molecular weight of 304.83 g/mol, XLogP of 3.35, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [(4-chloro-1-propan-2-ylpyrazol-5-yl)-(2,3-dihydro-1H-inden-1-yl)methyl]hydrazine is sourced from PubChem (CID 105234528), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).