[(2R,6R)-2-methyl-6-phenylmorpholin-4-yl]-pyrazin-2-ylmethanone

C16H17N3O2 — CID 94823256

IUPAC[(2R,6R)-2-methyl-6-phenylmorpholin-4-yl]-pyrazin-2-ylmethanone
SMILESC[C@@H]1CN(C(=O)c2cnccn2)C[C@@H](c2ccccc2)O1
InChIInChI=1S/C16H17N3O2/c1-12-10-19(16(20)14-9-17-7-8-18-14)11-15(21-12)13-5-3-2-4-6-13/h2-9,12,15H,10-11H2,1H3/t12-,15+/m1/s1
InChIKeyNETMZFFNOUKCOD-DOMZBBRYSA-N
MW283.33 g/mol
LogP2.08
Rot. Bonds2

About [(2R,6R)-2-methyl-6-phenylmorpholin-4-yl]-pyrazin-2-ylmethanone

[(2R,6R)-2-methyl-6-phenylmorpholin-4-yl]-pyrazin-2-ylmethanone (PubChem CID 94823256) has the molecular formula C16H17N3O2 and a molecular weight of 283.33 g/mol. Its IUPAC name is [(2R,6R)-2-methyl-6-phenylmorpholin-4-yl]-pyrazin-2-ylmethanone.

Molecular Properties

Compound Name[(2R,6R)-2-methyl-6-phenylmorpholin-4-yl]-pyrazin-2-ylmethanone
PubChem CID94823256
Molecular FormulaC16H17N3O2
Molecular Weight283.33 g/mol
Exact Mass283.13
IUPAC Name[(2R,6R)-2-methyl-6-phenylmorpholin-4-yl]-pyrazin-2-ylmethanone
SMILESC[C@@H]1CN(C(=O)c2cnccn2)C[C@@H](c2ccccc2)O1
InChIInChI=1S/C16H17N3O2/c1-12-10-19(16(20)14-9-17-7-8-18-14)11-15(21-12)13-5-3-2-4-6-13/h2-9,12,15H,10-11H2,1H3/t12-,15+/m1/s1
InChIKeyNETMZFFNOUKCOD-DOMZBBRYSA-N
XLogP2.08
TPSA55.32 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.33
LogP ≤ 52.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

(2-methyl-6-phenylmorpholin-4-yl)-pyrazin-2-ylmethanone
CID 47914748
2-(2-methyl-6-phenylmorpholine-4-carbonyl)pyridine-4-carboxylic acid
CID 122055413
[(2R)-2-phenylmorpholin-4-yl]-pyrazin-2-ylmethanone
CID 31414918
(2-methyl-6-phenylmorpholin-4-yl)-phenylmethanone
CID 47914795
5-[(2R,6S)-2-methyl-6-phenylmorpholine-4-carbonyl]pyridine-2-carboxylic acid
CID 124694837
5-[(2S,6S)-2-methyl-6-phenylmorpholine-4-carbonyl]pyridine-2-carboxylic acid
CID 124692496
5-(2-methyl-6-phenylmorpholine-4-carbonyl)pyridine-2-carboxylic acid
CID 122158408
[(2S,6S)-2-methyl-6-phenylmorpholin-4-yl]-(4-propan-2-ylpyrimidin-5-yl)methanone
CID 95583774
(2-methyl-6-phenylmorpholin-4-yl)-(4-propan-2-ylpyrimidin-5-yl)methanone
CID 56819953
3-[(2R,6R)-2-methyl-6-phenylmorpholine-4-carbonyl]-1H-pyridazin-6-one
CID 94823289
(2-methyl-6-phenylmorpholin-4-yl)-(5-phenyl-4,5-dihydro-1,2-oxazol-3-yl)methanone
CID 47914996
[2-(2-aminoethyl)-1,3-thiazol-4-yl]-(2-methyl-6-phenylmorpholin-4-yl)methanone
CID 120625875

Frequently Asked Questions

What is the IUPAC name of [(2R,6R)-2-methyl-6-phenylmorpholin-4-yl]-pyrazin-2-ylmethanone?
The IUPAC name of [(2R,6R)-2-methyl-6-phenylmorpholin-4-yl]-pyrazin-2-ylmethanone (CID 94823256) is [(2R,6R)-2-methyl-6-phenylmorpholin-4-yl]-pyrazin-2-ylmethanone.
What is the SMILES notation for [(2R,6R)-2-methyl-6-phenylmorpholin-4-yl]-pyrazin-2-ylmethanone?
The canonical SMILES for [(2R,6R)-2-methyl-6-phenylmorpholin-4-yl]-pyrazin-2-ylmethanone is C[C@@H]1CN(C(=O)c2cnccn2)C[C@@H](c2ccccc2)O1.
What is the InChIKey of [(2R,6R)-2-methyl-6-phenylmorpholin-4-yl]-pyrazin-2-ylmethanone?
The InChIKey is NETMZFFNOUKCOD-DOMZBBRYSA-N. The full InChI is InChI=1S/C16H17N3O2/c1-12-10-19(16(20)14-9-17-7-8-18-14)11-15(21-12)13-5-3-2-4-6-13/h2-9,12,15H,10-11H2,1H3/t12-,15+/m1/s1.
What are the key properties of [(2R,6R)-2-methyl-6-phenylmorpholin-4-yl]-pyrazin-2-ylmethanone?
[(2R,6R)-2-methyl-6-phenylmorpholin-4-yl]-pyrazin-2-ylmethanone has a molecular weight of 283.33 g/mol, XLogP of 2.08, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [(2R,6R)-2-methyl-6-phenylmorpholin-4-yl]-pyrazin-2-ylmethanone is sourced from PubChem (CID 94823256), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).