8-[(6-chloro-2-methylimidazo[1,2-a]pyridin-3-yl)methyl]-2,8-diazaspiro[4.5]decan-3-one

C17H21ClN4O — CID 50948858

IUPAC8-[(6-chloro-2-methylimidazo[1,2-a]pyridin-3-yl)methyl]-2,8-diazaspiro[4.5]decan-3-one
SMILESCc1nc2ccc(Cl)cn2c1CN1CCC2(CC1)CNC(=O)C2
InChIInChI=1S/C17H21ClN4O/c1-12-14(22-9-13(18)2-3-15(22)20-12)10-21-6-4-17(5-7-21)8-16(23)19-11-17/h2-3,9H,4-8,10-11H2,1H3,(H,19,23)
InChIKeyBRWUBTIJQSXRNY-UHFFFAOYSA-N
MW332.83 g/mol
LogP2.40
Rot. Bonds2

About 8-[(6-chloro-2-methylimidazo[1,2-a]pyridin-3-yl)methyl]-2,8-diazaspiro[4.5]decan-3-one

8-[(6-chloro-2-methylimidazo[1,2-a]pyridin-3-yl)methyl]-2,8-diazaspiro[4.5]decan-3-one (PubChem CID 50948858) has the molecular formula C17H21ClN4O and a molecular weight of 332.83 g/mol. Its IUPAC name is 8-[(6-chloro-2-methylimidazo[1,2-a]pyridin-3-yl)methyl]-2,8-diazaspiro[4.5]decan-3-one.

Molecular Properties

Compound Name8-[(6-chloro-2-methylimidazo[1,2-a]pyridin-3-yl)methyl]-2,8-diazaspiro[4.5]decan-3-one
PubChem CID50948858
Molecular FormulaC17H21ClN4O
Molecular Weight332.83 g/mol
Exact Mass332.14
IUPAC Name8-[(6-chloro-2-methylimidazo[1,2-a]pyridin-3-yl)methyl]-2,8-diazaspiro[4.5]decan-3-one
SMILESCc1nc2ccc(Cl)cn2c1CN1CCC2(CC1)CNC(=O)C2
InChIInChI=1S/C17H21ClN4O/c1-12-14(22-9-13(18)2-3-15(22)20-12)10-21-6-4-17(5-7-21)8-16(23)19-11-17/h2-3,9H,4-8,10-11H2,1H3,(H,19,23)
InChIKeyBRWUBTIJQSXRNY-UHFFFAOYSA-N
XLogP2.40
TPSA49.64 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.83
LogP ≤ 52.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[1-[(6-chloro-2-methylimidazo[1,2-a]pyridin-3-yl)methyl]-4-phenylpiperidin-4-yl]acetamide
CID 46981118
6-[(6-chloro-2-methylimidazo[1,2-a]pyridin-3-yl)methyl]-2-pyrimidin-5-yl-3,5,7,8-tetrahydropyrido[4,3-d]pyrimidin-4-one
CID 135946051
6-[(6-chloro-2-methylimidazo[1,2-a]pyridin-3-yl)methyl]-1,5,7,8-tetrahydropyrido[4,3-d]pyrimidine-2-thione
CID 24914650
8-[(6-chloro-4-oxo-1H-quinolin-2-yl)methyl]-2,8-diazaspiro[4.5]decan-3-one
CID 70772259
6-chloro-3-(piperazin-1-ylmethyl)-2-pyridin-4-ylimidazo[1,2-a]pyridine
CID 39148253
6-chloro-3-[(3-hydroxyazetidin-1-yl)methyl]-N,N-dimethylimidazo[1,2-a]pyridine-2-carboxamide
CID 56879033
6-chloro-3-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)imidazo[1,2-a]pyridine-2-carboxylic acid
CID 39122290
8-[(2-cyclohexylpyrimidin-5-yl)methyl]-2,8-diazaspiro[4.5]decan-3-one
CID 70754125
2-methyl-3-[(4-methylpiperidin-1-yl)methyl]imidazo[1,2-a]pyridin-6-amine
CID 82058433
2-methyl-3-(morpholin-4-ylmethyl)imidazo[1,2-a]pyridin-6-amine
CID 82058473
3-[[(4aS,8aR)-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-2-yl]methyl]-6-chloro-N,N-dimethylimidazo[1,2-a]pyridine-2-carboxamide
CID 29256694
7-chloro-3-[2-[4-(4-fluorobenzoyl)-4-methylpiperidin-1-yl]ethyl]-2-methylpyrido[1,2-a]pyrimidin-4-one
CID 151465918

Frequently Asked Questions

What is the IUPAC name of 8-[(6-chloro-2-methylimidazo[1,2-a]pyridin-3-yl)methyl]-2,8-diazaspiro[4.5]decan-3-one?
The IUPAC name of 8-[(6-chloro-2-methylimidazo[1,2-a]pyridin-3-yl)methyl]-2,8-diazaspiro[4.5]decan-3-one (CID 50948858) is 8-[(6-chloro-2-methylimidazo[1,2-a]pyridin-3-yl)methyl]-2,8-diazaspiro[4.5]decan-3-one.
What is the SMILES notation for 8-[(6-chloro-2-methylimidazo[1,2-a]pyridin-3-yl)methyl]-2,8-diazaspiro[4.5]decan-3-one?
The canonical SMILES for 8-[(6-chloro-2-methylimidazo[1,2-a]pyridin-3-yl)methyl]-2,8-diazaspiro[4.5]decan-3-one is Cc1nc2ccc(Cl)cn2c1CN1CCC2(CC1)CNC(=O)C2.
What is the InChIKey of 8-[(6-chloro-2-methylimidazo[1,2-a]pyridin-3-yl)methyl]-2,8-diazaspiro[4.5]decan-3-one?
The InChIKey is BRWUBTIJQSXRNY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21ClN4O/c1-12-14(22-9-13(18)2-3-15(22)20-12)10-21-6-4-17(5-7-21)8-16(23)19-11-17/h2-3,9H,4-8,10-11H2,1H3,(H,19,23).
What are the key properties of 8-[(6-chloro-2-methylimidazo[1,2-a]pyridin-3-yl)methyl]-2,8-diazaspiro[4.5]decan-3-one?
8-[(6-chloro-2-methylimidazo[1,2-a]pyridin-3-yl)methyl]-2,8-diazaspiro[4.5]decan-3-one has a molecular weight of 332.83 g/mol, XLogP of 2.40, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 8-[(6-chloro-2-methylimidazo[1,2-a]pyridin-3-yl)methyl]-2,8-diazaspiro[4.5]decan-3-one is sourced from PubChem (CID 50948858), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).