[(5-fluoro-2-pyridinyl)-(6-oxa-2-thiaspiro[4.5]decan-9-yl)methyl]hydrazine

C14H20FN3OS — CID 105248353

IUPAC[(5-fluoro-2-pyridinyl)-(6-oxa-2-thiaspiro[4.5]decan-9-yl)methyl]hydrazine
SMILESNNC(c1ccc(F)cn1)C1CCOC2(CCSC2)C1
InChIInChI=1S/C14H20FN3OS/c15-11-1-2-12(17-8-11)13(18-16)10-3-5-19-14(7-10)4-6-20-9-14/h1-2,8,10,13,18H,3-7,9,16H2
InChIKeyCLCMZTSDANCNFV-UHFFFAOYSA-N
MW297.40 g/mol
LogP2.03
Rot. Bonds3

About [(5-fluoro-2-pyridinyl)-(6-oxa-2-thiaspiro[4.5]decan-9-yl)methyl]hydrazine

[(5-fluoro-2-pyridinyl)-(6-oxa-2-thiaspiro[4.5]decan-9-yl)methyl]hydrazine (PubChem CID 105248353) has the molecular formula C14H20FN3OS and a molecular weight of 297.40 g/mol. Its IUPAC name is [(5-fluoro-2-pyridinyl)-(6-oxa-2-thiaspiro[4.5]decan-9-yl)methyl]hydrazine.

Molecular Properties

Compound Name[(5-fluoro-2-pyridinyl)-(6-oxa-2-thiaspiro[4.5]decan-9-yl)methyl]hydrazine
PubChem CID105248353
Molecular FormulaC14H20FN3OS
Molecular Weight297.40 g/mol
Exact Mass297.13
IUPAC Name[(5-fluoro-2-pyridinyl)-(6-oxa-2-thiaspiro[4.5]decan-9-yl)methyl]hydrazine
SMILESNNC(c1ccc(F)cn1)C1CCOC2(CCSC2)C1
InChIInChI=1S/C14H20FN3OS/c15-11-1-2-12(17-8-11)13(18-16)10-3-5-19-14(7-10)4-6-20-9-14/h1-2,8,10,13,18H,3-7,9,16H2
InChIKeyCLCMZTSDANCNFV-UHFFFAOYSA-N
XLogP2.03
TPSA60.17 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.40
LogP ≤ 52.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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

[(5-methylpyrazin-2-yl)-(6-oxa-2-thiaspiro[4.5]decan-9-yl)methyl]hydrazine
CID 105325943
[6-oxa-2-thiaspiro[4.5]decan-9-yl(2H-triazol-4-yl)methyl]hydrazine
CID 105254731
[(4-bromo-2-fluorophenyl)-(6-oxa-2-thiaspiro[4.5]decan-9-yl)methyl]hydrazine
CID 105280900
[(2,6-dimethyl-4-pyridinyl)-(6-oxa-2-thiaspiro[4.5]decan-9-yl)methyl]hydrazine
CID 107504849
1-(2,6-dioxaspiro[4.5]decan-9-yl)-1-(5-fluoro-2-pyridinyl)-N-methylmethanamine
CID 79911371
[(2-bromofuran-3-yl)-(6-oxa-2-thiaspiro[4.5]decan-9-yl)methyl]hydrazine
CID 106860112
[1-oxa-9-thiaspiro[5.5]undecan-4-yl(1,3-thiazol-4-yl)methyl]hydrazine
CID 105254321
[(3-chlorothiophen-2-yl)-(6-oxa-2-thiaspiro[4.5]decan-9-yl)methyl]hydrazine
CID 105325887
[(5-bromothiophen-3-yl)-(6-oxa-2-thiaspiro[4.5]decan-9-yl)methyl]hydrazine
CID 105325971
[1-oxa-9-thiaspiro[5.5]undecan-4-yl(2H-triazol-4-yl)methyl]hydrazine
CID 105254675
(5-fluoro-2-methylphenyl)-(6-oxa-2-thiaspiro[4.5]decan-9-yl)methanamine
CID 79913997
[(2-chloro-4-pyridinyl)-(1-oxa-9-thiaspiro[5.5]undecan-4-yl)methyl]hydrazine
CID 105252653

Frequently Asked Questions

What is the IUPAC name of [(5-fluoro-2-pyridinyl)-(6-oxa-2-thiaspiro[4.5]decan-9-yl)methyl]hydrazine?
The IUPAC name of [(5-fluoro-2-pyridinyl)-(6-oxa-2-thiaspiro[4.5]decan-9-yl)methyl]hydrazine (CID 105248353) is [(5-fluoro-2-pyridinyl)-(6-oxa-2-thiaspiro[4.5]decan-9-yl)methyl]hydrazine.
What is the SMILES notation for [(5-fluoro-2-pyridinyl)-(6-oxa-2-thiaspiro[4.5]decan-9-yl)methyl]hydrazine?
The canonical SMILES for [(5-fluoro-2-pyridinyl)-(6-oxa-2-thiaspiro[4.5]decan-9-yl)methyl]hydrazine is NNC(c1ccc(F)cn1)C1CCOC2(CCSC2)C1.
What is the InChIKey of [(5-fluoro-2-pyridinyl)-(6-oxa-2-thiaspiro[4.5]decan-9-yl)methyl]hydrazine?
The InChIKey is CLCMZTSDANCNFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20FN3OS/c15-11-1-2-12(17-8-11)13(18-16)10-3-5-19-14(7-10)4-6-20-9-14/h1-2,8,10,13,18H,3-7,9,16H2.
What are the key properties of [(5-fluoro-2-pyridinyl)-(6-oxa-2-thiaspiro[4.5]decan-9-yl)methyl]hydrazine?
[(5-fluoro-2-pyridinyl)-(6-oxa-2-thiaspiro[4.5]decan-9-yl)methyl]hydrazine has a molecular weight of 297.40 g/mol, XLogP of 2.03, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [(5-fluoro-2-pyridinyl)-(6-oxa-2-thiaspiro[4.5]decan-9-yl)methyl]hydrazine is sourced from PubChem (CID 105248353), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).