3-fluoro-8-prop-1-en-2-yl-1-oxa-3,8-diazaspiro[4.5]decane

C10H17FN2O — CID 178034055

IUPAC3-fluoro-8-prop-1-en-2-yl-1-oxa-3,8-diazaspiro[4.5]decane
SMILESC=C(C)N1CCC2(CC1)CN(F)CO2
InChIInChI=1S/C10H17FN2O/c1-9(2)12-5-3-10(4-6-12)7-13(11)8-14-10/h1,3-8H2,2H3
InChIKeyVVNHYFVIACLPKS-UHFFFAOYSA-N
MW200.26 g/mol
LogP1.53
Rot. Bonds1

About 3-fluoro-8-prop-1-en-2-yl-1-oxa-3,8-diazaspiro[4.5]decane

3-fluoro-8-prop-1-en-2-yl-1-oxa-3,8-diazaspiro[4.5]decane (PubChem CID 178034055) has the molecular formula C10H17FN2O and a molecular weight of 200.26 g/mol. Its IUPAC name is 3-fluoro-8-prop-1-en-2-yl-1-oxa-3,8-diazaspiro[4.5]decane.

Molecular Properties

Compound Name3-fluoro-8-prop-1-en-2-yl-1-oxa-3,8-diazaspiro[4.5]decane
PubChem CID178034055
Molecular FormulaC10H17FN2O
Molecular Weight200.26 g/mol
Exact Mass200.13
IUPAC Name3-fluoro-8-prop-1-en-2-yl-1-oxa-3,8-diazaspiro[4.5]decane
SMILESC=C(C)N1CCC2(CC1)CN(F)CO2
InChIInChI=1S/C10H17FN2O/c1-9(2)12-5-3-10(4-6-12)7-13(11)8-14-10/h1,3-8H2,2H3
InChIKeyVVNHYFVIACLPKS-UHFFFAOYSA-N
XLogP1.53
TPSA15.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.26
LogP ≤ 51.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'N-halo', 'substructure': 'N/A'}

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Related Compounds

9-fluoro-4-methyl-1-oxa-4,9-diazaspiro[5.5]undecane
CID 166686001
N-methyl-3-prop-2-enoyl-1-oxa-3,8-diazaspiro[4.5]decane-8-carboxamide
CID 166144007
4-fluoro-4-phenyl-1-prop-1-en-2-ylpiperidine
CID 123790281
ethane;1-prop-1-en-2-ylpiperidine
CID 142839582
4-methyl-4-phenyl-1-prop-1-en-2-ylpiperidine
CID 145156044
4-tert-butyl-4-methoxy-1-prop-1-en-2-ylazepane
CID 163870481
2-iodoiodanuidyl-8-prop-1-en-2-yl-2,8-diazaspiro[4.5]decan-3-one
CID 170578210
tert-butyl 3-prop-2-enoyl-1-oxa-3,7-diazaspiro[4.4]nonane-7-carboxylate
CID 166115550
4-(2,2-dimethylpropanoyl)-1-prop-1-en-2-ylpiperidine-4-carboxamide
CID 122675582
3-methyl-7-propan-2-yl-1-oxa-3,7-diazaspiro[4.4]nonane
CID 176693425
4-chloro-1-prop-1-en-2-ylpiperidine
CID 11367163
(4S)-7-methyl-1-oxa-7-azaspiro[3.4]octane
CID 177187480

Frequently Asked Questions

What is the IUPAC name of 3-fluoro-8-prop-1-en-2-yl-1-oxa-3,8-diazaspiro[4.5]decane?
The IUPAC name of 3-fluoro-8-prop-1-en-2-yl-1-oxa-3,8-diazaspiro[4.5]decane (CID 178034055) is 3-fluoro-8-prop-1-en-2-yl-1-oxa-3,8-diazaspiro[4.5]decane.
What is the SMILES notation for 3-fluoro-8-prop-1-en-2-yl-1-oxa-3,8-diazaspiro[4.5]decane?
The canonical SMILES for 3-fluoro-8-prop-1-en-2-yl-1-oxa-3,8-diazaspiro[4.5]decane is C=C(C)N1CCC2(CC1)CN(F)CO2.
What is the InChIKey of 3-fluoro-8-prop-1-en-2-yl-1-oxa-3,8-diazaspiro[4.5]decane?
The InChIKey is VVNHYFVIACLPKS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17FN2O/c1-9(2)12-5-3-10(4-6-12)7-13(11)8-14-10/h1,3-8H2,2H3.
What are the key properties of 3-fluoro-8-prop-1-en-2-yl-1-oxa-3,8-diazaspiro[4.5]decane?
3-fluoro-8-prop-1-en-2-yl-1-oxa-3,8-diazaspiro[4.5]decane has a molecular weight of 200.26 g/mol, XLogP of 1.53, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoro-8-prop-1-en-2-yl-1-oxa-3,8-diazaspiro[4.5]decane is sourced from PubChem (CID 178034055), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).