2-[(1-propan-2-ylpyrrolidin-2-yl)methyl]-1H-imidazo[1,2-a]pyridin-5-one

C15H21N3O — CID 117132074

IUPAC2-[(1-propan-2-ylpyrrolidin-2-yl)methyl]-1H-imidazo[1,2-a]pyridin-5-one
SMILESCC(C)N1CCCC1Cc1cn2c(=O)cccc2[nH]1
InChIInChI=1S/C15H21N3O/c1-11(2)17-8-4-5-13(17)9-12-10-18-14(16-12)6-3-7-15(18)19/h3,6-7,10-11,13,16H,4-5,8-9H2,1-2H3
InChIKeyUTNYVKJZZLGLAJ-UHFFFAOYSA-N
MW259.35 g/mol
LogP2.04
Rot. Bonds3

About 2-[(1-propan-2-ylpyrrolidin-2-yl)methyl]-1H-imidazo[1,2-a]pyridin-5-one

2-[(1-propan-2-ylpyrrolidin-2-yl)methyl]-1H-imidazo[1,2-a]pyridin-5-one (PubChem CID 117132074) has the molecular formula C15H21N3O and a molecular weight of 259.35 g/mol. Its IUPAC name is 2-[(1-propan-2-ylpyrrolidin-2-yl)methyl]-1H-imidazo[1,2-a]pyridin-5-one.

Molecular Properties

Compound Name2-[(1-propan-2-ylpyrrolidin-2-yl)methyl]-1H-imidazo[1,2-a]pyridin-5-one
PubChem CID117132074
Molecular FormulaC15H21N3O
Molecular Weight259.35 g/mol
Exact Mass259.17
IUPAC Name2-[(1-propan-2-ylpyrrolidin-2-yl)methyl]-1H-imidazo[1,2-a]pyridin-5-one
SMILESCC(C)N1CCCC1Cc1cn2c(=O)cccc2[nH]1
InChIInChI=1S/C15H21N3O/c1-11(2)17-8-4-5-13(17)9-12-10-18-14(16-12)6-3-7-15(18)19/h3,6-7,10-11,13,16H,4-5,8-9H2,1-2H3
InChIKeyUTNYVKJZZLGLAJ-UHFFFAOYSA-N
XLogP2.04
TPSA40.51 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.35
LogP ≤ 52.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[(1-methylpiperidin-2-yl)methyl]-1H-imidazo[1,2-a]pyridin-5-one
CID 117132188
2-(azetidin-3-ylmethyl)-1H-imidazo[1,2-a]pyridin-5-one
CID 105455271
2-[(1-propan-2-ylpyrrolidin-2-yl)methyl]imidazo[1,2-a]pyridine-5-carboxylic acid
CID 117132108
5-chloro-3-[(1-propan-2-ylpyrrolidin-2-yl)methyl]-[1,2,4]triazolo[4,3-a]pyridine
CID 117141708
3-[(1-propan-2-ylpyrrolidin-2-yl)methyl]imidazo[1,5-a]pyridine
CID 117139243
8-methyl-3-[(1-propan-2-ylpyrrolidin-2-yl)methyl]-[1,2,4]triazolo[4,3-a]pyridine
CID 117146664
[3-[(1-propan-2-ylpiperidin-2-yl)methyl]-[1,2,4]triazolo[4,3-a]pyridin-6-yl]methanamine
CID 117138303
3-[(1-propan-2-ylpyrrolidin-2-yl)methyl]imidazo[1,5-a]pyridine-6-carbaldehyde
CID 117138556
(1-propan-2-ylpyrrolidin-2-yl)methanamine
CID 2762717
2-[(1-propan-2-ylpyrrolidin-2-yl)methyl]-[1,2,4]triazolo[1,5-a]pyridine
CID 117129844
3-[(1-propan-2-ylpyrrolidin-2-yl)methyl]imidazo[1,5-a]pyridin-8-amine
CID 117146657
2-[(1-propan-2-ylpyrrolidin-2-yl)methyl]imidazo[1,2-a]pyridin-8-amine
CID 117136747

Frequently Asked Questions

What is the IUPAC name of 2-[(1-propan-2-ylpyrrolidin-2-yl)methyl]-1H-imidazo[1,2-a]pyridin-5-one?
The IUPAC name of 2-[(1-propan-2-ylpyrrolidin-2-yl)methyl]-1H-imidazo[1,2-a]pyridin-5-one (CID 117132074) is 2-[(1-propan-2-ylpyrrolidin-2-yl)methyl]-1H-imidazo[1,2-a]pyridin-5-one.
What is the SMILES notation for 2-[(1-propan-2-ylpyrrolidin-2-yl)methyl]-1H-imidazo[1,2-a]pyridin-5-one?
The canonical SMILES for 2-[(1-propan-2-ylpyrrolidin-2-yl)methyl]-1H-imidazo[1,2-a]pyridin-5-one is CC(C)N1CCCC1Cc1cn2c(=O)cccc2[nH]1.
What is the InChIKey of 2-[(1-propan-2-ylpyrrolidin-2-yl)methyl]-1H-imidazo[1,2-a]pyridin-5-one?
The InChIKey is UTNYVKJZZLGLAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3O/c1-11(2)17-8-4-5-13(17)9-12-10-18-14(16-12)6-3-7-15(18)19/h3,6-7,10-11,13,16H,4-5,8-9H2,1-2H3.
What are the key properties of 2-[(1-propan-2-ylpyrrolidin-2-yl)methyl]-1H-imidazo[1,2-a]pyridin-5-one?
2-[(1-propan-2-ylpyrrolidin-2-yl)methyl]-1H-imidazo[1,2-a]pyridin-5-one has a molecular weight of 259.35 g/mol, XLogP of 2.04, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(1-propan-2-ylpyrrolidin-2-yl)methyl]-1H-imidazo[1,2-a]pyridin-5-one is sourced from PubChem (CID 117132074), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).