[2-(1-benzothiophen-3-yl)-1-(2-methyloxan-2-yl)ethyl]hydrazine

C16H22N2OS — CID 105256128

IUPAC[2-(1-benzothiophen-3-yl)-1-(2-methyloxan-2-yl)ethyl]hydrazine
SMILESCC1(C(Cc2csc3ccccc23)NN)CCCCO1
InChIInChI=1S/C16H22N2OS/c1-16(8-4-5-9-19-16)15(18-17)10-12-11-20-14-7-3-2-6-13(12)14/h2-3,6-7,11,15,18H,4-5,8-10,17H2,1H3
InChIKeyZVYJSDZSAOVWCX-UHFFFAOYSA-N
MW290.43 g/mol
LogP3.23
Rot. Bonds4

About [2-(1-benzothiophen-3-yl)-1-(2-methyloxan-2-yl)ethyl]hydrazine

[2-(1-benzothiophen-3-yl)-1-(2-methyloxan-2-yl)ethyl]hydrazine (PubChem CID 105256128) has the molecular formula C16H22N2OS and a molecular weight of 290.43 g/mol. Its IUPAC name is [2-(1-benzothiophen-3-yl)-1-(2-methyloxan-2-yl)ethyl]hydrazine.

Molecular Properties

Compound Name[2-(1-benzothiophen-3-yl)-1-(2-methyloxan-2-yl)ethyl]hydrazine
PubChem CID105256128
Molecular FormulaC16H22N2OS
Molecular Weight290.43 g/mol
Exact Mass290.15
IUPAC Name[2-(1-benzothiophen-3-yl)-1-(2-methyloxan-2-yl)ethyl]hydrazine
SMILESCC1(C(Cc2csc3ccccc23)NN)CCCCO1
InChIInChI=1S/C16H22N2OS/c1-16(8-4-5-9-19-16)15(18-17)10-12-11-20-14-7-3-2-6-13(12)14/h2-3,6-7,11,15,18H,4-5,8-10,17H2,1H3
InChIKeyZVYJSDZSAOVWCX-UHFFFAOYSA-N
XLogP3.23
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.43
LogP ≤ 53.23
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

[1-(2-methyloxan-2-yl)-2-naphthalen-1-ylethyl]hydrazine
CID 105256213
2-(1-benzothiophen-3-yl)-N-ethyl-1-(1-ethylcyclopentyl)ethanamine
CID 115823821
[2-(1-benzothiophen-3-yl)-1-(2,2,3,3-tetramethylcyclopropyl)ethyl]hydrazine
CID 105291757
[2-(5-ethylthiophen-2-yl)-1-(2-methyloxolan-2-yl)ethyl]hydrazine
CID 105250845
[2-(4-bromothiophen-2-yl)-1-(2-methyloxolan-2-yl)ethyl]hydrazine
CID 105250920
[2-(4-chloro-2-fluorophenyl)-1-(2-methyloxan-2-yl)ethyl]hydrazine
CID 105256152
1-(1-benzothiophen-3-yl)butan-2-ylhydrazine
CID 105201011
[2-(4-bromo-2-chlorophenyl)-1-(2-methyloxan-2-yl)ethyl]hydrazine
CID 105256180
[1-(2-methyloxan-2-yl)-2-(1-methylpyrazol-3-yl)ethyl]hydrazine
CID 105256099
[3-(1-benzothiophen-3-yl)-1,1,1-trifluoropropan-2-yl]hydrazine
CID 105215688
[1-(1-benzothiophen-3-ylmethyl)cyclohexyl]methanamine
CID 63738318
3-(1-benzothiophen-3-yl)-2-hydrazinyl-N,N-dimethylpropan-1-amine
CID 105244750

Frequently Asked Questions

What is the IUPAC name of [2-(1-benzothiophen-3-yl)-1-(2-methyloxan-2-yl)ethyl]hydrazine?
The IUPAC name of [2-(1-benzothiophen-3-yl)-1-(2-methyloxan-2-yl)ethyl]hydrazine (CID 105256128) is [2-(1-benzothiophen-3-yl)-1-(2-methyloxan-2-yl)ethyl]hydrazine.
What is the SMILES notation for [2-(1-benzothiophen-3-yl)-1-(2-methyloxan-2-yl)ethyl]hydrazine?
The canonical SMILES for [2-(1-benzothiophen-3-yl)-1-(2-methyloxan-2-yl)ethyl]hydrazine is CC1(C(Cc2csc3ccccc23)NN)CCCCO1.
What is the InChIKey of [2-(1-benzothiophen-3-yl)-1-(2-methyloxan-2-yl)ethyl]hydrazine?
The InChIKey is ZVYJSDZSAOVWCX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N2OS/c1-16(8-4-5-9-19-16)15(18-17)10-12-11-20-14-7-3-2-6-13(12)14/h2-3,6-7,11,15,18H,4-5,8-10,17H2,1H3.
What are the key properties of [2-(1-benzothiophen-3-yl)-1-(2-methyloxan-2-yl)ethyl]hydrazine?
[2-(1-benzothiophen-3-yl)-1-(2-methyloxan-2-yl)ethyl]hydrazine has a molecular weight of 290.43 g/mol, XLogP of 3.23, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(1-benzothiophen-3-yl)-1-(2-methyloxan-2-yl)ethyl]hydrazine is sourced from PubChem (CID 105256128), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).