2-(3-fluoro-5-methylimidazo[1,2-a]pyridine-2-carbonyl)-7-(2-hydroxyethyl)-2,7-diazaspiro[4.5]decan-6-one

C19H23FN4O3 — CID 72926033

IUPAC2-(3-fluoro-5-methylimidazo[1,2-a]pyridine-2-carbonyl)-7-(2-hydroxyethyl)-2,7-diazaspiro[4.5]decan-6-one
SMILESCc1cccc2nc(C(=O)N3CCC4(CCCN(CCO)C4=O)C3)c(F)n12
InChIInChI=1S/C19H23FN4O3/c1-13-4-2-5-14-21-15(16(20)24(13)14)17(26)23-9-7-19(12-23)6-3-8-22(10-11-25)18(19)27/h2,4-5,25H,3,6-12H2,1H3
InChIKeyLAQWWAHVUUOAEW-UHFFFAOYSA-N
MW374.42 g/mol
LogP1.23
Rot. Bonds3

About 2-(3-fluoro-5-methylimidazo[1,2-a]pyridine-2-carbonyl)-7-(2-hydroxyethyl)-2,7-diazaspiro[4.5]decan-6-one

2-(3-fluoro-5-methylimidazo[1,2-a]pyridine-2-carbonyl)-7-(2-hydroxyethyl)-2,7-diazaspiro[4.5]decan-6-one (PubChem CID 72926033) has the molecular formula C19H23FN4O3 and a molecular weight of 374.42 g/mol. Its IUPAC name is 2-(3-fluoro-5-methylimidazo[1,2-a]pyridine-2-carbonyl)-7-(2-hydroxyethyl)-2,7-diazaspiro[4.5]decan-6-one.

Molecular Properties

Compound Name2-(3-fluoro-5-methylimidazo[1,2-a]pyridine-2-carbonyl)-7-(2-hydroxyethyl)-2,7-diazaspiro[4.5]decan-6-one
PubChem CID72926033
Molecular FormulaC19H23FN4O3
Molecular Weight374.42 g/mol
Exact Mass374.18
IUPAC Name2-(3-fluoro-5-methylimidazo[1,2-a]pyridine-2-carbonyl)-7-(2-hydroxyethyl)-2,7-diazaspiro[4.5]decan-6-one
SMILESCc1cccc2nc(C(=O)N3CCC4(CCCN(CCO)C4=O)C3)c(F)n12
InChIInChI=1S/C19H23FN4O3/c1-13-4-2-5-14-21-15(16(20)24(13)14)17(26)23-9-7-19(12-23)6-3-8-22(10-11-25)18(19)27/h2,4-5,25H,3,6-12H2,1H3
InChIKeyLAQWWAHVUUOAEW-UHFFFAOYSA-N
XLogP1.23
TPSA78.15 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms27
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.42
LogP ≤ 51.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(3-fluoro-5-methylimidazo[1,2-a]pyridine-2-carbonyl)-7-(2-hydroxyethyl)-2,7-diazaspiro[4.5]decan-6-one?
The IUPAC name of 2-(3-fluoro-5-methylimidazo[1,2-a]pyridine-2-carbonyl)-7-(2-hydroxyethyl)-2,7-diazaspiro[4.5]decan-6-one (CID 72926033) is 2-(3-fluoro-5-methylimidazo[1,2-a]pyridine-2-carbonyl)-7-(2-hydroxyethyl)-2,7-diazaspiro[4.5]decan-6-one.
What is the SMILES notation for 2-(3-fluoro-5-methylimidazo[1,2-a]pyridine-2-carbonyl)-7-(2-hydroxyethyl)-2,7-diazaspiro[4.5]decan-6-one?
The canonical SMILES for 2-(3-fluoro-5-methylimidazo[1,2-a]pyridine-2-carbonyl)-7-(2-hydroxyethyl)-2,7-diazaspiro[4.5]decan-6-one is Cc1cccc2nc(C(=O)N3CCC4(CCCN(CCO)C4=O)C3)c(F)n12.
What is the InChIKey of 2-(3-fluoro-5-methylimidazo[1,2-a]pyridine-2-carbonyl)-7-(2-hydroxyethyl)-2,7-diazaspiro[4.5]decan-6-one?
The InChIKey is LAQWWAHVUUOAEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23FN4O3/c1-13-4-2-5-14-21-15(16(20)24(13)14)17(26)23-9-7-19(12-23)6-3-8-22(10-11-25)18(19)27/h2,4-5,25H,3,6-12H2,1H3.
What are the key properties of 2-(3-fluoro-5-methylimidazo[1,2-a]pyridine-2-carbonyl)-7-(2-hydroxyethyl)-2,7-diazaspiro[4.5]decan-6-one?
2-(3-fluoro-5-methylimidazo[1,2-a]pyridine-2-carbonyl)-7-(2-hydroxyethyl)-2,7-diazaspiro[4.5]decan-6-one has a molecular weight of 374.42 g/mol, XLogP of 1.23, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-fluoro-5-methylimidazo[1,2-a]pyridine-2-carbonyl)-7-(2-hydroxyethyl)-2,7-diazaspiro[4.5]decan-6-one is sourced from PubChem (CID 72926033), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).