[1-(4-phenyloxan-4-yl)-2-thiophen-2-ylethyl]hydrazine

C17H22N2OS — CID 105217651

IUPAC[1-(4-phenyloxan-4-yl)-2-thiophen-2-ylethyl]hydrazine
SMILESNNC(Cc1cccs1)C1(c2ccccc2)CCOCC1
InChIInChI=1S/C17H22N2OS/c18-19-16(13-15-7-4-12-21-15)17(8-10-20-11-9-17)14-5-2-1-3-6-14/h1-7,12,16,19H,8-11,13,18H2
InChIKeyKUOQZOMPKUNTTI-UHFFFAOYSA-N
MW302.44 g/mol
LogP2.87
Rot. Bonds5

About [1-(4-phenyloxan-4-yl)-2-thiophen-2-ylethyl]hydrazine

[1-(4-phenyloxan-4-yl)-2-thiophen-2-ylethyl]hydrazine (PubChem CID 105217651) has the molecular formula C17H22N2OS and a molecular weight of 302.44 g/mol. Its IUPAC name is [1-(4-phenyloxan-4-yl)-2-thiophen-2-ylethyl]hydrazine.

Molecular Properties

Compound Name[1-(4-phenyloxan-4-yl)-2-thiophen-2-ylethyl]hydrazine
PubChem CID105217651
Molecular FormulaC17H22N2OS
Molecular Weight302.44 g/mol
Exact Mass302.15
IUPAC Name[1-(4-phenyloxan-4-yl)-2-thiophen-2-ylethyl]hydrazine
SMILESNNC(Cc1cccs1)C1(c2ccccc2)CCOCC1
InChIInChI=1S/C17H22N2OS/c18-19-16(13-15-7-4-12-21-15)17(8-10-20-11-9-17)14-5-2-1-3-6-14/h1-7,12,16,19H,8-11,13,18H2
InChIKeyKUOQZOMPKUNTTI-UHFFFAOYSA-N
XLogP2.87
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.44
LogP ≤ 52.87
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-methoxy-1-(4-phenyloxan-4-yl)butyl]hydrazine
CID 105217641
[1-(1-phenylcyclobutyl)-2-(1,3-thiazol-5-yl)ethyl]hydrazine
CID 105217281
[1-(1-phenylcyclohexyl)-2-(1,3-thiazol-5-yl)ethyl]hydrazine
CID 105217549
[1-(2-methyloxolan-2-yl)-2-thiophen-2-ylethyl]hydrazine
CID 105250936
[1-(1-phenylcyclopentyl)-2-thiophen-3-ylethyl]hydrazine
CID 105217504
[(4-phenyloxan-4-yl)-thiophen-3-ylmethyl]hydrazine
CID 105217605
[2-(furan-3-yl)-1-(1-phenylcyclopropyl)ethyl]hydrazine
CID 105217093
[1-(oxan-4-yl)-2-thiophen-2-ylethyl]hydrazine
CID 105211809
[2-(4-bromophenyl)-1-(1-phenylcyclopropyl)ethyl]hydrazine
CID 105217191
[1-(1-methoxy-3-methylcyclohexyl)-2-thiophen-2-ylethyl]hydrazine
CID 105277607
[3-methyl-1-(1-phenylcyclopropyl)butyl]hydrazine
CID 105217001
[3-ethyl-1-(1-phenylcyclopentyl)pentyl]hydrazine
CID 105217522

Frequently Asked Questions

What is the IUPAC name of [1-(4-phenyloxan-4-yl)-2-thiophen-2-ylethyl]hydrazine?
The IUPAC name of [1-(4-phenyloxan-4-yl)-2-thiophen-2-ylethyl]hydrazine (CID 105217651) is [1-(4-phenyloxan-4-yl)-2-thiophen-2-ylethyl]hydrazine.
What is the SMILES notation for [1-(4-phenyloxan-4-yl)-2-thiophen-2-ylethyl]hydrazine?
The canonical SMILES for [1-(4-phenyloxan-4-yl)-2-thiophen-2-ylethyl]hydrazine is NNC(Cc1cccs1)C1(c2ccccc2)CCOCC1.
What is the InChIKey of [1-(4-phenyloxan-4-yl)-2-thiophen-2-ylethyl]hydrazine?
The InChIKey is KUOQZOMPKUNTTI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N2OS/c18-19-16(13-15-7-4-12-21-15)17(8-10-20-11-9-17)14-5-2-1-3-6-14/h1-7,12,16,19H,8-11,13,18H2.
What are the key properties of [1-(4-phenyloxan-4-yl)-2-thiophen-2-ylethyl]hydrazine?
[1-(4-phenyloxan-4-yl)-2-thiophen-2-ylethyl]hydrazine has a molecular weight of 302.44 g/mol, XLogP of 2.87, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(4-phenyloxan-4-yl)-2-thiophen-2-ylethyl]hydrazine is sourced from PubChem (CID 105217651), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).