imidazo[1,2-a]pyridin-2-yl-[(3S,4R)-3-(methoxymethyl)-4-pyridin-4-ylpyrrolidin-1-yl]methanone

C19H20N4O2 — CID 110202696

IUPACimidazo[1,2-a]pyridin-2-yl-[(3S,4R)-3-(methoxymethyl)-4-pyridin-4-ylpyrrolidin-1-yl]methanone
SMILESCOC[C@@H]1CN(C(=O)c2cn3ccccc3n2)C[C@H]1c1ccncc1
InChIInChI=1S/C19H20N4O2/c1-25-13-15-10-23(11-16(15)14-5-7-20-8-6-14)19(24)17-12-22-9-3-2-4-18(22)21-17/h2-9,12,15-16H,10-11,13H2,1H3/t15-,16-/m0/s1
InChIKeyBPQUZHTVOMICKU-HOTGVXAUSA-N
MW336.40 g/mol
LogP2.23
Rot. Bonds4

About imidazo[1,2-a]pyridin-2-yl-[(3S,4R)-3-(methoxymethyl)-4-pyridin-4-ylpyrrolidin-1-yl]methanone

imidazo[1,2-a]pyridin-2-yl-[(3S,4R)-3-(methoxymethyl)-4-pyridin-4-ylpyrrolidin-1-yl]methanone (PubChem CID 110202696) has the molecular formula C19H20N4O2 and a molecular weight of 336.40 g/mol. Its IUPAC name is imidazo[1,2-a]pyridin-2-yl-[(3S,4R)-3-(methoxymethyl)-4-pyridin-4-ylpyrrolidin-1-yl]methanone.

Molecular Properties

Compound Nameimidazo[1,2-a]pyridin-2-yl-[(3S,4R)-3-(methoxymethyl)-4-pyridin-4-ylpyrrolidin-1-yl]methanone
PubChem CID110202696
Molecular FormulaC19H20N4O2
Molecular Weight336.40 g/mol
Exact Mass336.16
IUPAC Nameimidazo[1,2-a]pyridin-2-yl-[(3S,4R)-3-(methoxymethyl)-4-pyridin-4-ylpyrrolidin-1-yl]methanone
SMILESCOC[C@@H]1CN(C(=O)c2cn3ccccc3n2)C[C@H]1c1ccncc1
InChIInChI=1S/C19H20N4O2/c1-25-13-15-10-23(11-16(15)14-5-7-20-8-6-14)19(24)17-12-22-9-3-2-4-18(22)21-17/h2-9,12,15-16H,10-11,13H2,1H3/t15-,16-/m0/s1
InChIKeyBPQUZHTVOMICKU-HOTGVXAUSA-N
XLogP2.23
TPSA59.73 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.40
LogP ≤ 52.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

2-[1-(imidazo[1,2-a]pyridine-2-carbonyl)azetidin-3-yl]acetic acid
CID 64603533
imidazo[1,2-a]pyridin-2-yl-(3-phenylpyrrolidin-1-yl)methanone
CID 46981584
1-(imidazo[1,2-a]pyridine-2-carbonyl)piperidine-3-carboxylic acid
CID 43355877
ethyl 1-(imidazo[1,2-a]pyridine-2-carbonyl)piperidine-4-carboxylate
CID 87051265
(3R,4R)-4-cyclopropyl-1-(imidazo[1,2-a]pyridine-2-carbonyl)pyrrolidine-3-carboxylic acid
CID 120978575
[(3S,4R)-3-(hydroxymethyl)-4-pyridin-4-ylpyrrolidin-1-yl]-(2-methoxyphenyl)methanone
CID 110202770
2-[1-(imidazo[1,2-a]pyridine-2-carbonyl)piperidin-4-yl]acetic acid
CID 79612699
(1-ethylpyrazol-3-yl)-[(3S,4R)-3-(hydroxymethyl)-4-pyridin-4-ylpyrrolidin-1-yl]methanone
CID 110202784
imidazo[1,2-a]pyridin-2-yl-[(3R)-3-imidazol-1-ylpiperidin-1-yl]methanone
CID 95350987
N-(2-methoxyethyl)imidazo[1,2-a]pyridine-2-carboxamide
CID 51253266
1-imidazo[1,2-a]pyridin-2-ylethanone
CID 11194486
imidazo[1,2-a]pyridin-2-yl-[(3R)-3-(2-methylimidazol-1-yl)piperidin-1-yl]methanone
CID 95342530

Frequently Asked Questions

What is the IUPAC name of imidazo[1,2-a]pyridin-2-yl-[(3S,4R)-3-(methoxymethyl)-4-pyridin-4-ylpyrrolidin-1-yl]methanone?
The IUPAC name of imidazo[1,2-a]pyridin-2-yl-[(3S,4R)-3-(methoxymethyl)-4-pyridin-4-ylpyrrolidin-1-yl]methanone (CID 110202696) is imidazo[1,2-a]pyridin-2-yl-[(3S,4R)-3-(methoxymethyl)-4-pyridin-4-ylpyrrolidin-1-yl]methanone.
What is the SMILES notation for imidazo[1,2-a]pyridin-2-yl-[(3S,4R)-3-(methoxymethyl)-4-pyridin-4-ylpyrrolidin-1-yl]methanone?
The canonical SMILES for imidazo[1,2-a]pyridin-2-yl-[(3S,4R)-3-(methoxymethyl)-4-pyridin-4-ylpyrrolidin-1-yl]methanone is COC[C@@H]1CN(C(=O)c2cn3ccccc3n2)C[C@H]1c1ccncc1.
What is the InChIKey of imidazo[1,2-a]pyridin-2-yl-[(3S,4R)-3-(methoxymethyl)-4-pyridin-4-ylpyrrolidin-1-yl]methanone?
The InChIKey is BPQUZHTVOMICKU-HOTGVXAUSA-N. The full InChI is InChI=1S/C19H20N4O2/c1-25-13-15-10-23(11-16(15)14-5-7-20-8-6-14)19(24)17-12-22-9-3-2-4-18(22)21-17/h2-9,12,15-16H,10-11,13H2,1H3/t15-,16-/m0/s1.
What are the key properties of imidazo[1,2-a]pyridin-2-yl-[(3S,4R)-3-(methoxymethyl)-4-pyridin-4-ylpyrrolidin-1-yl]methanone?
imidazo[1,2-a]pyridin-2-yl-[(3S,4R)-3-(methoxymethyl)-4-pyridin-4-ylpyrrolidin-1-yl]methanone has a molecular weight of 336.40 g/mol, XLogP of 2.23, 4 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-[(3S,4R)-3-(methoxymethyl)-4-pyridin-4-ylpyrrolidin-1-yl]methanone is sourced from PubChem (CID 110202696), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).