[(5-chlorothiophen-2-yl)-(4-propoxyphenyl)methyl]hydrazine

C14H17ClN2OS — CID 105303654

IUPAC[(5-chlorothiophen-2-yl)-(4-propoxyphenyl)methyl]hydrazine
SMILESCCCOc1ccc(C(NN)c2ccc(Cl)s2)cc1
InChIInChI=1S/C14H17ClN2OS/c1-2-9-18-11-5-3-10(4-6-11)14(17-16)12-7-8-13(15)19-12/h3-8,14,17H,2,9,16H2,1H3
InChIKeyPXCAHBRBZCYDQS-UHFFFAOYSA-N
MW296.82 g/mol
LogP3.74
Rot. Bonds6

About [(5-chlorothiophen-2-yl)-(4-propoxyphenyl)methyl]hydrazine

[(5-chlorothiophen-2-yl)-(4-propoxyphenyl)methyl]hydrazine (PubChem CID 105303654) has the molecular formula C14H17ClN2OS and a molecular weight of 296.82 g/mol. Its IUPAC name is [(5-chlorothiophen-2-yl)-(4-propoxyphenyl)methyl]hydrazine.

Molecular Properties

Compound Name[(5-chlorothiophen-2-yl)-(4-propoxyphenyl)methyl]hydrazine
PubChem CID105303654
Molecular FormulaC14H17ClN2OS
Molecular Weight296.82 g/mol
Exact Mass296.08
IUPAC Name[(5-chlorothiophen-2-yl)-(4-propoxyphenyl)methyl]hydrazine
SMILESCCCOc1ccc(C(NN)c2ccc(Cl)s2)cc1
InChIInChI=1S/C14H17ClN2OS/c1-2-9-18-11-5-3-10(4-6-11)14(17-16)12-7-8-13(15)19-12/h3-8,14,17H,2,9,16H2,1H3
InChIKeyPXCAHBRBZCYDQS-UHFFFAOYSA-N
XLogP3.74
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.82
LogP ≤ 53.74
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

[(4-butoxyphenyl)-(4-chlorophenyl)methyl]hydrazine
CID 105281210
[5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl-(4-propoxyphenyl)methyl]hydrazine
CID 105303655
1-(5-chlorothiophen-2-yl)-N-methyl-1-(5-propoxy-3-pyridinyl)methanamine
CID 105026778
[(4-butoxyphenyl)-(2-chlorophenyl)methyl]hydrazine
CID 105287427
[(5-methylpyrimidin-2-yl)-(4-propoxyphenyl)methyl]hydrazine
CID 105261658
(5-chlorothiophen-2-yl)-(3-propoxyphenyl)methanamine
CID 62921378
[(5-chlorothiophen-2-yl)-(5-methylfuran-3-yl)methyl]hydrazine
CID 105328238
[1-(5-chlorothiophen-2-yl)-3-propoxypropyl]hydrazine
CID 105328204
[(2,5-dimethylphenyl)-(4-propoxyphenyl)methyl]hydrazine
CID 105303653
[(5-fluoro-2-pyridinyl)-(4-propoxyphenyl)methyl]hydrazine
CID 105248508
[(3-methoxyphenyl)-(4-propoxyphenyl)methyl]hydrazine
CID 105191804
[(5-chlorothiophen-2-yl)-(4-methoxy-3-methylphenyl)methyl]hydrazine
CID 105258417

Frequently Asked Questions

What is the IUPAC name of [(5-chlorothiophen-2-yl)-(4-propoxyphenyl)methyl]hydrazine?
The IUPAC name of [(5-chlorothiophen-2-yl)-(4-propoxyphenyl)methyl]hydrazine (CID 105303654) is [(5-chlorothiophen-2-yl)-(4-propoxyphenyl)methyl]hydrazine.
What is the SMILES notation for [(5-chlorothiophen-2-yl)-(4-propoxyphenyl)methyl]hydrazine?
The canonical SMILES for [(5-chlorothiophen-2-yl)-(4-propoxyphenyl)methyl]hydrazine is CCCOc1ccc(C(NN)c2ccc(Cl)s2)cc1.
What is the InChIKey of [(5-chlorothiophen-2-yl)-(4-propoxyphenyl)methyl]hydrazine?
The InChIKey is PXCAHBRBZCYDQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17ClN2OS/c1-2-9-18-11-5-3-10(4-6-11)14(17-16)12-7-8-13(15)19-12/h3-8,14,17H,2,9,16H2,1H3.
What are the key properties of [(5-chlorothiophen-2-yl)-(4-propoxyphenyl)methyl]hydrazine?
[(5-chlorothiophen-2-yl)-(4-propoxyphenyl)methyl]hydrazine has a molecular weight of 296.82 g/mol, XLogP of 3.74, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [(5-chlorothiophen-2-yl)-(4-propoxyphenyl)methyl]hydrazine is sourced from PubChem (CID 105303654), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).