(2-methyl-1,3-oxazol-4-yl)-[(3S)-3-(3-pyridin-3-yloxypyrazin-2-yl)piperidin-1-yl]methanone

C19H19N5O3 — CID 95844320

IUPAC(2-methyl-1,3-oxazol-4-yl)-[(3S)-3-(3-pyridin-3-yloxypyrazin-2-yl)piperidin-1-yl]methanone
SMILESCc1nc(C(=O)N2CCC[C@H](c3nccnc3Oc3cccnc3)C2)co1
InChIInChI=1S/C19H19N5O3/c1-13-23-16(12-26-13)19(25)24-9-3-4-14(11-24)17-18(22-8-7-21-17)27-15-5-2-6-20-10-15/h2,5-8,10,12,14H,3-4,9,11H2,1H3/t14-/m0/s1
InChIKeyBPXYAWQNBUOATR-AWEZNQCLSA-N
MW365.39 g/mol
LogP2.98
Rot. Bonds4

About (2-methyl-1,3-oxazol-4-yl)-[(3S)-3-(3-pyridin-3-yloxypyrazin-2-yl)piperidin-1-yl]methanone

(2-methyl-1,3-oxazol-4-yl)-[(3S)-3-(3-pyridin-3-yloxypyrazin-2-yl)piperidin-1-yl]methanone (PubChem CID 95844320) has the molecular formula C19H19N5O3 and a molecular weight of 365.39 g/mol. Its IUPAC name is (2-methyl-1,3-oxazol-4-yl)-[(3S)-3-(3-pyridin-3-yloxypyrazin-2-yl)piperidin-1-yl]methanone.

Molecular Properties

Compound Name(2-methyl-1,3-oxazol-4-yl)-[(3S)-3-(3-pyridin-3-yloxypyrazin-2-yl)piperidin-1-yl]methanone
PubChem CID95844320
Molecular FormulaC19H19N5O3
Molecular Weight365.39 g/mol
Exact Mass365.15
IUPAC Name(2-methyl-1,3-oxazol-4-yl)-[(3S)-3-(3-pyridin-3-yloxypyrazin-2-yl)piperidin-1-yl]methanone
SMILESCc1nc(C(=O)N2CCC[C@H](c3nccnc3Oc3cccnc3)C2)co1
InChIInChI=1S/C19H19N5O3/c1-13-23-16(12-26-13)19(25)24-9-3-4-14(11-24)17-18(22-8-7-21-17)27-15-5-2-6-20-10-15/h2,5-8,10,12,14H,3-4,9,11H2,1H3/t14-/m0/s1
InChIKeyBPXYAWQNBUOATR-AWEZNQCLSA-N
XLogP2.98
TPSA94.24 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.39
LogP ≤ 52.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Related Compounds

[(3R)-3-[3-(4-methoxyphenoxy)pyrazin-2-yl]piperidin-1-yl]-(2-methyl-1,3-oxazol-4-yl)methanone
CID 95823457
[4-[3-(2-methoxyphenoxy)pyrazin-2-yl]piperidin-1-yl]-(2-methyl-1,3-oxazol-4-yl)methanone
CID 95823462
(6-methyl-2-piperidin-1-ylpyrimidin-4-yl)-[(3S)-3-(3-phenoxypyrazin-2-yl)piperidin-1-yl]methanone
CID 124981897
[(3R)-3-[3-(3-fluorophenoxy)pyrazin-2-yl]piperidin-1-yl]-pyrazin-2-ylmethanone
CID 95822353
[(3S)-3-[3-(3-methylphenoxy)pyrazin-2-yl]piperidin-1-yl]-pyridin-2-ylmethanone
CID 95822457
[3-[6-(3-methoxyphenoxy)pyrazin-2-yl]piperidin-1-yl]-(2-methyl-1,3-oxazol-4-yl)methanone
CID 110256743
(2-methyl-1,3-oxazol-4-yl)-[(3R)-3-[6-(3-methylphenyl)-2-pyridinyl]piperidin-1-yl]methanone
CID 95810788
1-[(3S)-3-[3-(3-methylphenoxy)pyrazin-2-yl]piperidin-1-yl]ethanone
CID 95821922
[(3R)-1-(2-methyl-1,3-oxazole-4-carbonyl)piperidin-3-yl]-pyrrolidin-1-ylmethanone
CID 95828746
[(3R)-3-[3-(4-methoxyphenoxy)pyrazin-2-yl]piperidin-1-yl]-(5-pyrimidin-5-yl-3-pyridinyl)methanone
CID 124987464
[(3R)-3-[3-(4-methylphenoxy)pyrazin-2-yl]piperidin-1-yl]-(oxan-4-yl)methanone
CID 95823111
[(3S)-3-[3-(4-chlorophenoxy)pyrazin-2-yl]piperidin-1-yl]-(1-methylpyrazol-4-yl)methanone
CID 95823148

Frequently Asked Questions

What is the IUPAC name of (2-methyl-1,3-oxazol-4-yl)-[(3S)-3-(3-pyridin-3-yloxypyrazin-2-yl)piperidin-1-yl]methanone?
The IUPAC name of (2-methyl-1,3-oxazol-4-yl)-[(3S)-3-(3-pyridin-3-yloxypyrazin-2-yl)piperidin-1-yl]methanone (CID 95844320) is (2-methyl-1,3-oxazol-4-yl)-[(3S)-3-(3-pyridin-3-yloxypyrazin-2-yl)piperidin-1-yl]methanone.
What is the SMILES notation for (2-methyl-1,3-oxazol-4-yl)-[(3S)-3-(3-pyridin-3-yloxypyrazin-2-yl)piperidin-1-yl]methanone?
The canonical SMILES for (2-methyl-1,3-oxazol-4-yl)-[(3S)-3-(3-pyridin-3-yloxypyrazin-2-yl)piperidin-1-yl]methanone is Cc1nc(C(=O)N2CCC[C@H](c3nccnc3Oc3cccnc3)C2)co1.
What is the InChIKey of (2-methyl-1,3-oxazol-4-yl)-[(3S)-3-(3-pyridin-3-yloxypyrazin-2-yl)piperidin-1-yl]methanone?
The InChIKey is BPXYAWQNBUOATR-AWEZNQCLSA-N. The full InChI is InChI=1S/C19H19N5O3/c1-13-23-16(12-26-13)19(25)24-9-3-4-14(11-24)17-18(22-8-7-21-17)27-15-5-2-6-20-10-15/h2,5-8,10,12,14H,3-4,9,11H2,1H3/t14-/m0/s1.
What are the key properties of (2-methyl-1,3-oxazol-4-yl)-[(3S)-3-(3-pyridin-3-yloxypyrazin-2-yl)piperidin-1-yl]methanone?
(2-methyl-1,3-oxazol-4-yl)-[(3S)-3-(3-pyridin-3-yloxypyrazin-2-yl)piperidin-1-yl]methanone has a molecular weight of 365.39 g/mol, XLogP of 2.98, 4 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for (2-methyl-1,3-oxazol-4-yl)-[(3S)-3-(3-pyridin-3-yloxypyrazin-2-yl)piperidin-1-yl]methanone is sourced from PubChem (CID 95844320), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).