imidazo[1,2-a]pyridin-2-yl-[(3R)-3-imidazol-1-ylpiperidin-1-yl]methanone

C16H17N5O — CID 95350987

IUPACimidazo[1,2-a]pyridin-2-yl-[(3R)-3-imidazol-1-ylpiperidin-1-yl]methanone
SMILESO=C(c1cn2ccccc2n1)N1CCC[C@@H](n2ccnc2)C1
InChIInChI=1S/C16H17N5O/c22-16(14-11-19-7-2-1-5-15(19)18-14)20-8-3-4-13(10-20)21-9-6-17-12-21/h1-2,5-7,9,11-13H,3-4,8,10H2/t13-/m1/s1
InChIKeyDXKKRBIZPRUJRJ-CYBMUJFWSA-N
MW295.35 g/mol
LogP2.01
Rot. Bonds2

About imidazo[1,2-a]pyridin-2-yl-[(3R)-3-imidazol-1-ylpiperidin-1-yl]methanone

imidazo[1,2-a]pyridin-2-yl-[(3R)-3-imidazol-1-ylpiperidin-1-yl]methanone (PubChem CID 95350987) has the molecular formula C16H17N5O and a molecular weight of 295.35 g/mol. Its IUPAC name is imidazo[1,2-a]pyridin-2-yl-[(3R)-3-imidazol-1-ylpiperidin-1-yl]methanone.

Molecular Properties

Compound Nameimidazo[1,2-a]pyridin-2-yl-[(3R)-3-imidazol-1-ylpiperidin-1-yl]methanone
PubChem CID95350987
Molecular FormulaC16H17N5O
Molecular Weight295.35 g/mol
Exact Mass295.14
IUPAC Nameimidazo[1,2-a]pyridin-2-yl-[(3R)-3-imidazol-1-ylpiperidin-1-yl]methanone
SMILESO=C(c1cn2ccccc2n1)N1CCC[C@@H](n2ccnc2)C1
InChIInChI=1S/C16H17N5O/c22-16(14-11-19-7-2-1-5-15(19)18-14)20-8-3-4-13(10-20)21-9-6-17-12-21/h1-2,5-7,9,11-13H,3-4,8,10H2/t13-/m1/s1
InChIKeyDXKKRBIZPRUJRJ-CYBMUJFWSA-N
XLogP2.01
TPSA55.43 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.35
LogP ≤ 52.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

2-imidazo[1,2-a]pyridin-2-yl-1-[(3R)-3-imidazol-1-ylpiperidin-1-yl]ethanone
CID 95313099
imidazo[1,2-a]pyridin-2-yl-[(3R)-3-(2-methylimidazol-1-yl)piperidin-1-yl]methanone
CID 95342530
1-(imidazo[1,2-a]pyridine-2-carbonyl)piperidine-3-carboxylic acid
CID 43355877
[(3S)-3-imidazol-1-ylpiperidin-1-yl]-(2-phenyltriazol-4-yl)methanone
CID 95323916
imidazo[1,2-a]pyridin-2-yl-(3-phenylpyrrolidin-1-yl)methanone
CID 46981584
[(3R)-3-imidazol-1-ylpiperidin-1-yl]-(2-pyridin-2-yl-1,3-thiazol-4-yl)methanone
CID 95314062
3-[(3R)-3-imidazol-1-ylpiperidine-1-carbonyl]-2H-isoquinolin-1-one
CID 95569131
[(3R)-3-imidazol-1-ylpiperidin-1-yl]-(6-pyrrolidin-1-ylpyridazin-3-yl)methanone
CID 95314596
[(3S)-1-(imidazo[1,2-a]pyridine-2-carbonyl)piperidin-3-yl]-naphthalen-2-ylmethanone
CID 42518126
5-[(3S)-3-imidazol-1-ylpiperidine-1-carbonyl]thiophene-2-carboxamide
CID 95319281
[(3S)-3-imidazol-1-ylpiperidin-1-yl]-(3-pyrrol-1-ylphenyl)methanone
CID 95313622
3-[(3S)-3-imidazol-1-ylpiperidine-1-carbonyl]benzamide
CID 95569094

Frequently Asked Questions

What is the IUPAC name of imidazo[1,2-a]pyridin-2-yl-[(3R)-3-imidazol-1-ylpiperidin-1-yl]methanone?
The IUPAC name of imidazo[1,2-a]pyridin-2-yl-[(3R)-3-imidazol-1-ylpiperidin-1-yl]methanone (CID 95350987) is imidazo[1,2-a]pyridin-2-yl-[(3R)-3-imidazol-1-ylpiperidin-1-yl]methanone.
What is the SMILES notation for imidazo[1,2-a]pyridin-2-yl-[(3R)-3-imidazol-1-ylpiperidin-1-yl]methanone?
The canonical SMILES for imidazo[1,2-a]pyridin-2-yl-[(3R)-3-imidazol-1-ylpiperidin-1-yl]methanone is O=C(c1cn2ccccc2n1)N1CCC[C@@H](n2ccnc2)C1.
What is the InChIKey of imidazo[1,2-a]pyridin-2-yl-[(3R)-3-imidazol-1-ylpiperidin-1-yl]methanone?
The InChIKey is DXKKRBIZPRUJRJ-CYBMUJFWSA-N. The full InChI is InChI=1S/C16H17N5O/c22-16(14-11-19-7-2-1-5-15(19)18-14)20-8-3-4-13(10-20)21-9-6-17-12-21/h1-2,5-7,9,11-13H,3-4,8,10H2/t13-/m1/s1.
What are the key properties of imidazo[1,2-a]pyridin-2-yl-[(3R)-3-imidazol-1-ylpiperidin-1-yl]methanone?
imidazo[1,2-a]pyridin-2-yl-[(3R)-3-imidazol-1-ylpiperidin-1-yl]methanone has a molecular weight of 295.35 g/mol, XLogP of 2.01, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for imidazo[1,2-a]pyridin-2-yl-[(3R)-3-imidazol-1-ylpiperidin-1-yl]methanone is sourced from PubChem (CID 95350987), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).