[(4-propylphenyl)-(thiolan-3-yl)methyl]hydrazine

C14H22N2S — CID 105303906

IUPAC[(4-propylphenyl)-(thiolan-3-yl)methyl]hydrazine
SMILESCCCc1ccc(C(NN)C2CCSC2)cc1
InChIInChI=1S/C14H22N2S/c1-2-3-11-4-6-12(7-5-11)14(16-15)13-8-9-17-10-13/h4-7,13-14,16H,2-3,8-10,15H2,1H3
InChIKeyKUNFQULNYMSSFK-UHFFFAOYSA-N
MW250.41 g/mol
LogP2.90
Rot. Bonds5

About [(4-propylphenyl)-(thiolan-3-yl)methyl]hydrazine

[(4-propylphenyl)-(thiolan-3-yl)methyl]hydrazine (PubChem CID 105303906) has the molecular formula C14H22N2S and a molecular weight of 250.41 g/mol. Its IUPAC name is [(4-propylphenyl)-(thiolan-3-yl)methyl]hydrazine.

Molecular Properties

Compound Name[(4-propylphenyl)-(thiolan-3-yl)methyl]hydrazine
PubChem CID105303906
Molecular FormulaC14H22N2S
Molecular Weight250.41 g/mol
Exact Mass250.15
IUPAC Name[(4-propylphenyl)-(thiolan-3-yl)methyl]hydrazine
SMILESCCCc1ccc(C(NN)C2CCSC2)cc1
InChIInChI=1S/C14H22N2S/c1-2-3-11-4-6-12(7-5-11)14(16-15)13-8-9-17-10-13/h4-7,13-14,16H,2-3,8-10,15H2,1H3
InChIKeyKUNFQULNYMSSFK-UHFFFAOYSA-N
XLogP2.90
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.41
LogP ≤ 52.90
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

[(4-chlorophenyl)-(thiolan-3-yl)methyl]hydrazine
CID 105281249
[(4-methylthiomorpholin-3-yl)-(4-propylphenyl)methyl]hydrazine
CID 106446359
[(3-methylcyclohexyl)-(4-propylphenyl)methyl]hydrazine
CID 105210218
N-[cyclopropyl-(4-propylphenyl)methyl]ethanamine
CID 43491617
[2-(4-propan-2-ylphenyl)-1-(thiolan-3-yl)ethyl]hydrazine
CID 105297335
[(4-chloro-3-methoxyphenyl)-(thiolan-3-yl)methyl]hydrazine
CID 105320870
[2-cyclopropyl-2-methoxy-1-(4-propylphenyl)ethyl]hydrazine
CID 105272652
[2-cyclopropyl-2-ethoxy-1-(4-propylphenyl)ethyl]hydrazine
CID 105272997
N-[(4-cyclopropyloxyphenyl)-(thiolan-3-yl)methyl]ethanamine
CID 105188447
4-[methylamino-(4-propylphenyl)methyl]cyclohexan-1-ol
CID 116957004
[(4-tert-butylcyclohexyl)-(4-ethylphenyl)methyl]hydrazine
CID 105232777
1-(4-ethoxyphenyl)-N-methyl-1-(thiolan-3-yl)methanamine
CID 105140814

Frequently Asked Questions

What is the IUPAC name of [(4-propylphenyl)-(thiolan-3-yl)methyl]hydrazine?
The IUPAC name of [(4-propylphenyl)-(thiolan-3-yl)methyl]hydrazine (CID 105303906) is [(4-propylphenyl)-(thiolan-3-yl)methyl]hydrazine.
What is the SMILES notation for [(4-propylphenyl)-(thiolan-3-yl)methyl]hydrazine?
The canonical SMILES for [(4-propylphenyl)-(thiolan-3-yl)methyl]hydrazine is CCCc1ccc(C(NN)C2CCSC2)cc1.
What is the InChIKey of [(4-propylphenyl)-(thiolan-3-yl)methyl]hydrazine?
The InChIKey is KUNFQULNYMSSFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2S/c1-2-3-11-4-6-12(7-5-11)14(16-15)13-8-9-17-10-13/h4-7,13-14,16H,2-3,8-10,15H2,1H3.
What are the key properties of [(4-propylphenyl)-(thiolan-3-yl)methyl]hydrazine?
[(4-propylphenyl)-(thiolan-3-yl)methyl]hydrazine has a molecular weight of 250.41 g/mol, XLogP of 2.90, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(4-propylphenyl)-(thiolan-3-yl)methyl]hydrazine is sourced from PubChem (CID 105303906), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).