furan-3-yl-[2-(1,3-thiazol-2-yl)-2,7-diazaspiro[3.4]octan-7-yl]methanone

C14H15N3O2S — CID 97472726

IUPACfuran-3-yl-[2-(1,3-thiazol-2-yl)-2,7-diazaspiro[3.4]octan-7-yl]methanone
SMILESO=C(c1ccoc1)N1CCC2(C1)CN(c1nccs1)C2
InChIInChI=1S/C14H15N3O2S/c18-12(11-1-5-19-7-11)16-4-2-14(8-16)9-17(10-14)13-15-3-6-20-13/h1,3,5-7H,2,4,8-10H2
InChIKeyGEYYLZDIHPZJHU-UHFFFAOYSA-N
MW289.36 g/mol
LogP2.09
Rot. Bonds2

About furan-3-yl-[2-(1,3-thiazol-2-yl)-2,7-diazaspiro[3.4]octan-7-yl]methanone

furan-3-yl-[2-(1,3-thiazol-2-yl)-2,7-diazaspiro[3.4]octan-7-yl]methanone (PubChem CID 97472726) has the molecular formula C14H15N3O2S and a molecular weight of 289.36 g/mol. Its IUPAC name is furan-3-yl-[2-(1,3-thiazol-2-yl)-2,7-diazaspiro[3.4]octan-7-yl]methanone.

Molecular Properties

Compound Namefuran-3-yl-[2-(1,3-thiazol-2-yl)-2,7-diazaspiro[3.4]octan-7-yl]methanone
PubChem CID97472726
Molecular FormulaC14H15N3O2S
Molecular Weight289.36 g/mol
Exact Mass289.09
IUPAC Namefuran-3-yl-[2-(1,3-thiazol-2-yl)-2,7-diazaspiro[3.4]octan-7-yl]methanone
SMILESO=C(c1ccoc1)N1CCC2(C1)CN(c1nccs1)C2
InChIInChI=1S/C14H15N3O2S/c18-12(11-1-5-19-7-11)16-4-2-14(8-16)9-17(10-14)13-15-3-6-20-13/h1,3,5-7H,2,4,8-10H2
InChIKeyGEYYLZDIHPZJHU-UHFFFAOYSA-N
XLogP2.09
TPSA49.58 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.36
LogP ≤ 52.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

1-[7-(furan-3-carbonyl)-2,7-diazaspiro[3.4]octan-2-yl]ethanone
CID 97472729
furan-3-yl-[3-(thiophene-2-carbonyl)-3,9-diazaspiro[5.5]undecan-9-yl]methanone
CID 97370696
furan-3-yl-[4-(1,3-thiazol-2-ylmethyl)-1-oxa-4,9-diazaspiro[5.5]undecan-9-yl]methanone;2,2,2-trifluoroacetic acid
CID 155824954
(5R)-7-(furan-3-carbonyl)-2-pyrimidin-5-yl-2,7-diazaspiro[4.4]nonan-3-one
CID 97374104
2-[7-(1,3-thiazol-2-yl)-2,7-diazaspiro[3.4]octan-2-yl]ethanol
CID 97472802
furan-3-yl-(11-pyrazin-2-yl-8-oxa-2,11-diazaspiro[5.6]dodecan-2-yl)methanone;2,2,2-trifluoroacetic acid
CID 155837244
[9-[(4-fluorophenyl)methyl]-2,9-diazaspiro[4.5]decan-2-yl]-(furan-3-yl)methanone
CID 45171495
(3S)-8-(cyclopropanecarbonyl)-2-(furan-3-carbonyl)-2,8-diazaspiro[4.5]decane-3-carboxylic acid
CID 95861935
furan-3-yl-(4-pyridin-4-ylpiperazin-1-yl)methanone
CID 43048919
furan-3-yl-[4-hydroxy-4-(trifluoromethyl)piperidin-1-yl]methanone
CID 84592483
1-(furan-3-carbonyl)-3-methylpiperidine-3-carboxylic acid
CID 63133574
[(4R)-3,3-difluoro-4-methylpiperidin-1-yl]-(furan-3-yl)methanone
CID 129349585

Frequently Asked Questions

What is the IUPAC name of furan-3-yl-[2-(1,3-thiazol-2-yl)-2,7-diazaspiro[3.4]octan-7-yl]methanone?
The IUPAC name of furan-3-yl-[2-(1,3-thiazol-2-yl)-2,7-diazaspiro[3.4]octan-7-yl]methanone (CID 97472726) is furan-3-yl-[2-(1,3-thiazol-2-yl)-2,7-diazaspiro[3.4]octan-7-yl]methanone.
What is the SMILES notation for furan-3-yl-[2-(1,3-thiazol-2-yl)-2,7-diazaspiro[3.4]octan-7-yl]methanone?
The canonical SMILES for furan-3-yl-[2-(1,3-thiazol-2-yl)-2,7-diazaspiro[3.4]octan-7-yl]methanone is O=C(c1ccoc1)N1CCC2(C1)CN(c1nccs1)C2.
What is the InChIKey of furan-3-yl-[2-(1,3-thiazol-2-yl)-2,7-diazaspiro[3.4]octan-7-yl]methanone?
The InChIKey is GEYYLZDIHPZJHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N3O2S/c18-12(11-1-5-19-7-11)16-4-2-14(8-16)9-17(10-14)13-15-3-6-20-13/h1,3,5-7H,2,4,8-10H2.
What are the key properties of furan-3-yl-[2-(1,3-thiazol-2-yl)-2,7-diazaspiro[3.4]octan-7-yl]methanone?
furan-3-yl-[2-(1,3-thiazol-2-yl)-2,7-diazaspiro[3.4]octan-7-yl]methanone has a molecular weight of 289.36 g/mol, XLogP of 2.09, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for furan-3-yl-[2-(1,3-thiazol-2-yl)-2,7-diazaspiro[3.4]octan-7-yl]methanone is sourced from PubChem (CID 97472726), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).