[2-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]-(1,4,5-oxadiazepan-4-yl)methanone

C19H20N4O3 — CID 155952840

IUPAC[2-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]-(1,4,5-oxadiazepan-4-yl)methanone
SMILESO=C(c1ccccc1OCc1cn2ccccc2n1)N1CCOCCN1
InChIInChI=1S/C19H20N4O3/c24-19(23-10-12-25-11-8-20-23)16-5-1-2-6-17(16)26-14-15-13-22-9-4-3-7-18(22)21-15/h1-7,9,13,20H,8,10-12,14H2
InChIKeyVSOUDUXLVQFZIH-UHFFFAOYSA-N
MW352.39 g/mol
LogP1.89
Rot. Bonds4

About [2-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]-(1,4,5-oxadiazepan-4-yl)methanone

[2-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]-(1,4,5-oxadiazepan-4-yl)methanone (PubChem CID 155952840) has the molecular formula C19H20N4O3 and a molecular weight of 352.39 g/mol. Its IUPAC name is [2-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]-(1,4,5-oxadiazepan-4-yl)methanone.

Molecular Properties

Compound Name[2-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]-(1,4,5-oxadiazepan-4-yl)methanone
PubChem CID155952840
Molecular FormulaC19H20N4O3
Molecular Weight352.39 g/mol
Exact Mass352.15
IUPAC Name[2-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]-(1,4,5-oxadiazepan-4-yl)methanone
SMILESO=C(c1ccccc1OCc1cn2ccccc2n1)N1CCOCCN1
InChIInChI=1S/C19H20N4O3/c24-19(23-10-12-25-11-8-20-23)16-5-1-2-6-17(16)26-14-15-13-22-9-4-3-7-18(22)21-15/h1-7,9,13,20H,8,10-12,14H2
InChIKeyVSOUDUXLVQFZIH-UHFFFAOYSA-N
XLogP1.89
TPSA68.10 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.39
LogP ≤ 51.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

[2-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]phenyl]-piperazin-1-ylmethanone
CID 119402980
3-(imidazo[1,2-a]pyridin-2-ylmethoxy)-2-methylbenzoic acid
CID 82810212
N-[1-[2-(imidazo[1,2-a]pyridin-2-ylmethoxy)benzoyl]piperidin-4-yl]benzamide
CID 167931551
2-(imidazo[1,2-a]pyridin-2-ylmethoxy)benzenecarboximidamide
CID 24695598
3-bromo-2-(imidazo[1,2-a]pyridin-2-ylmethoxy)benzoic acid
CID 61391322
3-(imidazo[1,2-a]pyridin-2-ylmethoxy)pyridine-4-carboxylic acid
CID 81445806
N-(4-carbamoylphenyl)-2-(imidazo[1,2-a]pyridin-2-ylmethoxy)benzamide
CID 18096076
2-(imidazo[1,2-a]pyridin-2-ylmethoxy)-N-(4-phenoxyphenyl)benzamide
CID 18274448
3-(imidazo[1,2-a]pyridin-2-ylmethoxy)-4-methylbenzoic acid
CID 60698887
5-chloro-2-(imidazo[1,2-a]pyridin-2-ylmethoxy)benzamide
CID 17469223
N-(3-bromophenyl)-2-(imidazo[1,2-a]pyridin-2-ylmethoxy)benzamide
CID 18096051
(3S,4S)-4-methyl-1-[2-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzoyl]pyrrolidine-3-carboxylic acid
CID 122112307

Frequently Asked Questions

What is the IUPAC name of [2-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]-(1,4,5-oxadiazepan-4-yl)methanone?
The IUPAC name of [2-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]-(1,4,5-oxadiazepan-4-yl)methanone (CID 155952840) is [2-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]-(1,4,5-oxadiazepan-4-yl)methanone.
What is the SMILES notation for [2-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]-(1,4,5-oxadiazepan-4-yl)methanone?
The canonical SMILES for [2-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]-(1,4,5-oxadiazepan-4-yl)methanone is O=C(c1ccccc1OCc1cn2ccccc2n1)N1CCOCCN1.
What is the InChIKey of [2-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]-(1,4,5-oxadiazepan-4-yl)methanone?
The InChIKey is VSOUDUXLVQFZIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N4O3/c24-19(23-10-12-25-11-8-20-23)16-5-1-2-6-17(16)26-14-15-13-22-9-4-3-7-18(22)21-15/h1-7,9,13,20H,8,10-12,14H2.
What are the key properties of [2-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]-(1,4,5-oxadiazepan-4-yl)methanone?
[2-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]-(1,4,5-oxadiazepan-4-yl)methanone has a molecular weight of 352.39 g/mol, XLogP of 1.89, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]-(1,4,5-oxadiazepan-4-yl)methanone is sourced from PubChem (CID 155952840), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).