1-(1-methylpyrazol-3-yl)-2-[2-(oxan-4-yl)-7-propan-2-yloxyimidazo[1,2-a]pyridin-6-yl]ethanone

C21H26N4O3 — CID 164993715

IUPAC1-(1-methylpyrazol-3-yl)-2-[2-(oxan-4-yl)-7-propan-2-yloxyimidazo[1,2-a]pyridin-6-yl]ethanone
SMILESCC(C)Oc1cc2nc(C3CCOCC3)cn2cc1CC(=O)c1ccn(C)n1
InChIInChI=1S/C21H26N4O3/c1-14(2)28-20-11-21-22-18(15-5-8-27-9-6-15)13-25(21)12-16(20)10-19(26)17-4-7-24(3)23-17/h4,7,11-15H,5-6,8-10H2,1-3H3
InChIKeyHFYVZJOAXHGTMJ-UHFFFAOYSA-N
MW382.46 g/mol
LogP3.17
Rot. Bonds6

About 1-(1-methylpyrazol-3-yl)-2-[2-(oxan-4-yl)-7-propan-2-yloxyimidazo[1,2-a]pyridin-6-yl]ethanone

1-(1-methylpyrazol-3-yl)-2-[2-(oxan-4-yl)-7-propan-2-yloxyimidazo[1,2-a]pyridin-6-yl]ethanone (PubChem CID 164993715) has the molecular formula C21H26N4O3 and a molecular weight of 382.46 g/mol. Its IUPAC name is 1-(1-methylpyrazol-3-yl)-2-[2-(oxan-4-yl)-7-propan-2-yloxyimidazo[1,2-a]pyridin-6-yl]ethanone.

Molecular Properties

Compound Name1-(1-methylpyrazol-3-yl)-2-[2-(oxan-4-yl)-7-propan-2-yloxyimidazo[1,2-a]pyridin-6-yl]ethanone
PubChem CID164993715
Molecular FormulaC21H26N4O3
Molecular Weight382.46 g/mol
Exact Mass382.20
IUPAC Name1-(1-methylpyrazol-3-yl)-2-[2-(oxan-4-yl)-7-propan-2-yloxyimidazo[1,2-a]pyridin-6-yl]ethanone
SMILESCC(C)Oc1cc2nc(C3CCOCC3)cn2cc1CC(=O)c1ccn(C)n1
InChIInChI=1S/C21H26N4O3/c1-14(2)28-20-11-21-22-18(15-5-8-27-9-6-15)13-25(21)12-16(20)10-19(26)17-4-7-24(3)23-17/h4,7,11-15H,5-6,8-10H2,1-3H3
InChIKeyHFYVZJOAXHGTMJ-UHFFFAOYSA-N
XLogP3.17
TPSA70.65 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500382.46
LogP ≤ 53.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Related Compounds

1-[1-(difluoromethyl)pyrazol-3-yl]-2-[2-(oxan-4-yl)-7-propan-2-yloxyimidazo[1,2-a]pyridin-6-yl]ethanone
CID 164991172
1-[2-(2-methyl-4-pyridinyl)-1,3-oxazol-4-yl]-2-[2-(oxan-4-yl)-7-propan-2-yloxyimidazo[1,2-a]pyridin-6-yl]ethanone
CID 165089165
2-[8-methoxy-2-(oxan-4-yl)imidazo[1,2-a]pyrazin-6-yl]-1-(1-methylpyrazol-3-yl)ethanone
CID 165048614
1-[6-(difluoromethyl)-2-pyridinyl]-2-[7-ethoxy-2-(oxan-4-yl)imidazo[1,2-a]pyridin-6-yl]ethanone
CID 164961282
1-(2-cyclopropyl-1,3-thiazol-4-yl)-2-[7-ethoxy-2-(oxan-4-yl)imidazo[1,2-a]pyridin-6-yl]ethanone
CID 165097298
2-[7-ethoxy-2-(oxan-4-yl)imidazo[1,2-a]pyridin-6-yl]-1-[6-(methoxymethyl)-2-pyridinyl]ethanone
CID 164986455
2-[7-ethoxy-2-(oxan-4-yl)imidazo[1,2-a]pyridin-6-yl]-1-(2-methoxyphenyl)ethanone
CID 165011161
N-[7-ethoxy-2-(oxan-4-yl)imidazo[1,2-a]pyridin-6-yl]-1-propan-2-ylpyrazole-3-carboxamide
CID 154655076
1-[6-(difluoromethyl)-2-pyridinyl]-2-[7-fluoro-2-(oxan-4-yl)imidazo[1,2-a]pyridin-6-yl]ethanone
CID 165046881
6-(difluoromethyl)-N-[2-(oxolan-3-yl)-7-propan-2-yloxyimidazo[1,2-a]pyridin-6-yl]pyridine-2-carboxamide
CID 154655212
2-[8-methoxy-2-(oxan-4-yl)imidazo[1,2-a]pyrazin-6-yl]-1-[1-(2-methylpropyl)pyrazol-3-yl]ethanone
CID 165050739
2-[7-ethoxy-2-(oxan-4-yl)imidazo[1,2-a]pyridin-6-yl]-1-(3-methoxy-4-methylthiophen-2-yl)ethanone
CID 165018408

Frequently Asked Questions

What is the IUPAC name of 1-(1-methylpyrazol-3-yl)-2-[2-(oxan-4-yl)-7-propan-2-yloxyimidazo[1,2-a]pyridin-6-yl]ethanone?
The IUPAC name of 1-(1-methylpyrazol-3-yl)-2-[2-(oxan-4-yl)-7-propan-2-yloxyimidazo[1,2-a]pyridin-6-yl]ethanone (CID 164993715) is 1-(1-methylpyrazol-3-yl)-2-[2-(oxan-4-yl)-7-propan-2-yloxyimidazo[1,2-a]pyridin-6-yl]ethanone.
What is the SMILES notation for 1-(1-methylpyrazol-3-yl)-2-[2-(oxan-4-yl)-7-propan-2-yloxyimidazo[1,2-a]pyridin-6-yl]ethanone?
The canonical SMILES for 1-(1-methylpyrazol-3-yl)-2-[2-(oxan-4-yl)-7-propan-2-yloxyimidazo[1,2-a]pyridin-6-yl]ethanone is CC(C)Oc1cc2nc(C3CCOCC3)cn2cc1CC(=O)c1ccn(C)n1.
What is the InChIKey of 1-(1-methylpyrazol-3-yl)-2-[2-(oxan-4-yl)-7-propan-2-yloxyimidazo[1,2-a]pyridin-6-yl]ethanone?
The InChIKey is HFYVZJOAXHGTMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H26N4O3/c1-14(2)28-20-11-21-22-18(15-5-8-27-9-6-15)13-25(21)12-16(20)10-19(26)17-4-7-24(3)23-17/h4,7,11-15H,5-6,8-10H2,1-3H3.
What are the key properties of 1-(1-methylpyrazol-3-yl)-2-[2-(oxan-4-yl)-7-propan-2-yloxyimidazo[1,2-a]pyridin-6-yl]ethanone?
1-(1-methylpyrazol-3-yl)-2-[2-(oxan-4-yl)-7-propan-2-yloxyimidazo[1,2-a]pyridin-6-yl]ethanone has a molecular weight of 382.46 g/mol, XLogP of 3.17, 6 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-methylpyrazol-3-yl)-2-[2-(oxan-4-yl)-7-propan-2-yloxyimidazo[1,2-a]pyridin-6-yl]ethanone is sourced from PubChem (CID 164993715), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).