(2,2-dimethylmorpholin-4-yl)-[5-(methylamino)pyrazin-2-yl]methanone

C12H18N4O2 — CID 107374614

IUPAC(2,2-dimethylmorpholin-4-yl)-[5-(methylamino)pyrazin-2-yl]methanone
SMILESCNc1cnc(C(=O)N2CCOC(C)(C)C2)cn1
InChIInChI=1S/C12H18N4O2/c1-12(2)8-16(4-5-18-12)11(17)9-6-15-10(13-3)7-14-9/h6-7H,4-5,8H2,1-3H3,(H,13,15)
InChIKeyZVQQZNZNQUFVHK-UHFFFAOYSA-N
MW250.30 g/mol
LogP0.77
Rot. Bonds2

About (2,2-dimethylmorpholin-4-yl)-[5-(methylamino)pyrazin-2-yl]methanone

(2,2-dimethylmorpholin-4-yl)-[5-(methylamino)pyrazin-2-yl]methanone (PubChem CID 107374614) has the molecular formula C12H18N4O2 and a molecular weight of 250.30 g/mol. Its IUPAC name is (2,2-dimethylmorpholin-4-yl)-[5-(methylamino)pyrazin-2-yl]methanone.

Molecular Properties

Compound Name(2,2-dimethylmorpholin-4-yl)-[5-(methylamino)pyrazin-2-yl]methanone
PubChem CID107374614
Molecular FormulaC12H18N4O2
Molecular Weight250.30 g/mol
Exact Mass250.14
IUPAC Name(2,2-dimethylmorpholin-4-yl)-[5-(methylamino)pyrazin-2-yl]methanone
SMILESCNc1cnc(C(=O)N2CCOC(C)(C)C2)cn1
InChIInChI=1S/C12H18N4O2/c1-12(2)8-16(4-5-18-12)11(17)9-6-15-10(13-3)7-14-9/h6-7H,4-5,8H2,1-3H3,(H,13,15)
InChIKeyZVQQZNZNQUFVHK-UHFFFAOYSA-N
XLogP0.77
TPSA67.35 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.30
LogP ≤ 50.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

(2,2-dimethylmorpholin-4-yl)-[4-(methylamino)-2-pyridinyl]methanone
CID 62170441
azocan-1-yl-[5-(methylamino)pyrazin-2-yl]methanone
CID 107374083
6-(2,2-dimethylmorpholine-4-carbonyl)pyridine-3-carbothioamide
CID 63723243
(3-methoxy-3-methylpiperidin-1-yl)-[5-(methylamino)pyrazin-2-yl]methanone
CID 107394944
(3,4-dimethoxypyrrolidin-1-yl)-[5-(methylamino)pyrazin-2-yl]methanone
CID 107377317
(6-amino-2-pyridinyl)-(2,2-dimethylmorpholin-4-yl)methanone
CID 55052527
[5-(methylamino)pyrazin-2-yl]-(4-methylsulfanylpiperidin-1-yl)methanone
CID 114238348
[4-amino-2-(methylamino)-1,3-thiazol-5-yl]-(2,2-dimethylmorpholin-4-yl)methanone
CID 116670458
N-[4-[[5-(morpholine-4-carbonyl)pyrazin-2-yl]amino]phenyl]acetamide
CID 109276515
(2,2-dimethylmorpholin-4-yl)-(2-fluoro-4-pyridinyl)methanone
CID 61294351
(2,2-dimethylmorpholin-4-yl)-(2-phenyl-1,3-thiazol-5-yl)methanone
CID 86991467
(3,5-diaminophenyl)-(2,2-dimethylmorpholin-4-yl)methanone
CID 61093702

Frequently Asked Questions

What is the IUPAC name of (2,2-dimethylmorpholin-4-yl)-[5-(methylamino)pyrazin-2-yl]methanone?
The IUPAC name of (2,2-dimethylmorpholin-4-yl)-[5-(methylamino)pyrazin-2-yl]methanone (CID 107374614) is (2,2-dimethylmorpholin-4-yl)-[5-(methylamino)pyrazin-2-yl]methanone.
What is the SMILES notation for (2,2-dimethylmorpholin-4-yl)-[5-(methylamino)pyrazin-2-yl]methanone?
The canonical SMILES for (2,2-dimethylmorpholin-4-yl)-[5-(methylamino)pyrazin-2-yl]methanone is CNc1cnc(C(=O)N2CCOC(C)(C)C2)cn1.
What is the InChIKey of (2,2-dimethylmorpholin-4-yl)-[5-(methylamino)pyrazin-2-yl]methanone?
The InChIKey is ZVQQZNZNQUFVHK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N4O2/c1-12(2)8-16(4-5-18-12)11(17)9-6-15-10(13-3)7-14-9/h6-7H,4-5,8H2,1-3H3,(H,13,15).
What are the key properties of (2,2-dimethylmorpholin-4-yl)-[5-(methylamino)pyrazin-2-yl]methanone?
(2,2-dimethylmorpholin-4-yl)-[5-(methylamino)pyrazin-2-yl]methanone has a molecular weight of 250.30 g/mol, XLogP of 0.77, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2,2-dimethylmorpholin-4-yl)-[5-(methylamino)pyrazin-2-yl]methanone is sourced from PubChem (CID 107374614), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).