[(5S,6S)-6-methoxy-1-oxa-8-azaspiro[4.5]decan-8-yl]-(6-methylimidazo[1,2-a]pyridin-2-yl)methanone

C18H23N3O3 — CID 110156778

IUPAC[(5S,6S)-6-methoxy-1-oxa-8-azaspiro[4.5]decan-8-yl]-(6-methylimidazo[1,2-a]pyridin-2-yl)methanone
SMILESCO[C@H]1CN(C(=O)c2cn3cc(C)ccc3n2)CC[C@@]12CCCO2
InChIInChI=1S/C18H23N3O3/c1-13-4-5-16-19-14(11-21(16)10-13)17(22)20-8-7-18(6-3-9-24-18)15(12-20)23-2/h4-5,10-11,15H,3,6-9,12H2,1-2H3/t15-,18-/m0/s1
InChIKeyFMHBFHLSKWCHHU-YJBOKZPZSA-N
MW329.40 g/mol
LogP2.05
Rot. Bonds2

About [(5S,6S)-6-methoxy-1-oxa-8-azaspiro[4.5]decan-8-yl]-(6-methylimidazo[1,2-a]pyridin-2-yl)methanone

[(5S,6S)-6-methoxy-1-oxa-8-azaspiro[4.5]decan-8-yl]-(6-methylimidazo[1,2-a]pyridin-2-yl)methanone (PubChem CID 110156778) has the molecular formula C18H23N3O3 and a molecular weight of 329.40 g/mol. Its IUPAC name is [(5S,6S)-6-methoxy-1-oxa-8-azaspiro[4.5]decan-8-yl]-(6-methylimidazo[1,2-a]pyridin-2-yl)methanone.

Molecular Properties

Compound Name[(5S,6S)-6-methoxy-1-oxa-8-azaspiro[4.5]decan-8-yl]-(6-methylimidazo[1,2-a]pyridin-2-yl)methanone
PubChem CID110156778
Molecular FormulaC18H23N3O3
Molecular Weight329.40 g/mol
Exact Mass329.17
IUPAC Name[(5S,6S)-6-methoxy-1-oxa-8-azaspiro[4.5]decan-8-yl]-(6-methylimidazo[1,2-a]pyridin-2-yl)methanone
SMILESCO[C@H]1CN(C(=O)c2cn3cc(C)ccc3n2)CC[C@@]12CCCO2
InChIInChI=1S/C18H23N3O3/c1-13-4-5-16-19-14(11-21(16)10-13)17(22)20-8-7-18(6-3-9-24-18)15(12-20)23-2/h4-5,10-11,15H,3,6-9,12H2,1-2H3/t15-,18-/m0/s1
InChIKeyFMHBFHLSKWCHHU-YJBOKZPZSA-N
XLogP2.05
TPSA56.07 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.40
LogP ≤ 52.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of [(5S,6S)-6-methoxy-1-oxa-8-azaspiro[4.5]decan-8-yl]-(6-methylimidazo[1,2-a]pyridin-2-yl)methanone?
The IUPAC name of [(5S,6S)-6-methoxy-1-oxa-8-azaspiro[4.5]decan-8-yl]-(6-methylimidazo[1,2-a]pyridin-2-yl)methanone (CID 110156778) is [(5S,6S)-6-methoxy-1-oxa-8-azaspiro[4.5]decan-8-yl]-(6-methylimidazo[1,2-a]pyridin-2-yl)methanone.
What is the SMILES notation for [(5S,6S)-6-methoxy-1-oxa-8-azaspiro[4.5]decan-8-yl]-(6-methylimidazo[1,2-a]pyridin-2-yl)methanone?
The canonical SMILES for [(5S,6S)-6-methoxy-1-oxa-8-azaspiro[4.5]decan-8-yl]-(6-methylimidazo[1,2-a]pyridin-2-yl)methanone is CO[C@H]1CN(C(=O)c2cn3cc(C)ccc3n2)CC[C@@]12CCCO2.
What is the InChIKey of [(5S,6S)-6-methoxy-1-oxa-8-azaspiro[4.5]decan-8-yl]-(6-methylimidazo[1,2-a]pyridin-2-yl)methanone?
The InChIKey is FMHBFHLSKWCHHU-YJBOKZPZSA-N. The full InChI is InChI=1S/C18H23N3O3/c1-13-4-5-16-19-14(11-21(16)10-13)17(22)20-8-7-18(6-3-9-24-18)15(12-20)23-2/h4-5,10-11,15H,3,6-9,12H2,1-2H3/t15-,18-/m0/s1.
What are the key properties of [(5S,6S)-6-methoxy-1-oxa-8-azaspiro[4.5]decan-8-yl]-(6-methylimidazo[1,2-a]pyridin-2-yl)methanone?
[(5S,6S)-6-methoxy-1-oxa-8-azaspiro[4.5]decan-8-yl]-(6-methylimidazo[1,2-a]pyridin-2-yl)methanone has a molecular weight of 329.40 g/mol, XLogP of 2.05, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [(5S,6S)-6-methoxy-1-oxa-8-azaspiro[4.5]decan-8-yl]-(6-methylimidazo[1,2-a]pyridin-2-yl)methanone is sourced from PubChem (CID 110156778), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).