2-(dimethylamino)-1-[3-[4-(dimethylamino)-6-methylpyrimidin-2-yl]morpholin-4-yl]ethanone

C15H25N5O2 — CID 110113853

IUPAC2-(dimethylamino)-1-[3-[4-(dimethylamino)-6-methylpyrimidin-2-yl]morpholin-4-yl]ethanone
SMILESCc1cc(N(C)C)nc(C2COCCN2C(=O)CN(C)C)n1
InChIInChI=1S/C15H25N5O2/c1-11-8-13(19(4)5)17-15(16-11)12-10-22-7-6-20(12)14(21)9-18(2)3/h8,12H,6-7,9-10H2,1-5H3
InChIKeyGCAJVRJPLFPESW-UHFFFAOYSA-N
MW307.40 g/mol
LogP0.31
Rot. Bonds4

About 2-(dimethylamino)-1-[3-[4-(dimethylamino)-6-methylpyrimidin-2-yl]morpholin-4-yl]ethanone

2-(dimethylamino)-1-[3-[4-(dimethylamino)-6-methylpyrimidin-2-yl]morpholin-4-yl]ethanone (PubChem CID 110113853) has the molecular formula C15H25N5O2 and a molecular weight of 307.40 g/mol. Its IUPAC name is 2-(dimethylamino)-1-[3-[4-(dimethylamino)-6-methylpyrimidin-2-yl]morpholin-4-yl]ethanone.

Molecular Properties

Compound Name2-(dimethylamino)-1-[3-[4-(dimethylamino)-6-methylpyrimidin-2-yl]morpholin-4-yl]ethanone
PubChem CID110113853
Molecular FormulaC15H25N5O2
Molecular Weight307.40 g/mol
Exact Mass307.20
IUPAC Name2-(dimethylamino)-1-[3-[4-(dimethylamino)-6-methylpyrimidin-2-yl]morpholin-4-yl]ethanone
SMILESCc1cc(N(C)C)nc(C2COCCN2C(=O)CN(C)C)n1
InChIInChI=1S/C15H25N5O2/c1-11-8-13(19(4)5)17-15(16-11)12-10-22-7-6-20(12)14(21)9-18(2)3/h8,12H,6-7,9-10H2,1-5H3
InChIKeyGCAJVRJPLFPESW-UHFFFAOYSA-N
XLogP0.31
TPSA61.80 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.40
LogP ≤ 50.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

2-[3-[4-(dimethylamino)-6-methylpyrimidin-2-yl]morpholin-4-yl]-1-pyrrolidin-1-ylethanone
CID 110113847
[(3S)-3-[4-(dimethylamino)-6-methylpyrimidin-2-yl]morpholin-4-yl]-(1,3-thiazol-4-yl)methanone
CID 125016495
[(3S)-3-[4-(dimethylamino)-6-methylpyrimidin-2-yl]morpholin-4-yl]-(3-methyl-2-pyridinyl)methanone
CID 124990143
3-methoxy-1-[3-[4-methyl-6-(methylamino)pyrimidin-2-yl]morpholin-4-yl]propan-1-one
CID 110113786
1-[3-(4-anilinopyrimidin-2-yl)morpholin-4-yl]-2-(dimethylamino)ethanone
CID 131638506
N,N,6-trimethyl-2-[(3R)-4-(1,3-thiazol-4-ylmethyl)morpholin-3-yl]pyrimidin-4-amine
CID 124995845
N,N,6-trimethyl-2-[(3R)-4-(2-phenoxyethyl)morpholin-3-yl]pyrimidin-4-amine
CID 124998959
(2,6-dimethyl-4-pyridinyl)-[(3R)-3-[4-[ethyl(methyl)amino]pyrimidin-2-yl]morpholin-4-yl]methanone
CID 97483353
1-[(3R)-3-[4-methyl-6-(methylamino)pyrimidin-2-yl]morpholin-4-yl]-4-(1,2,4-triazol-1-yl)butan-1-one
CID 124940280
[(3R)-3-[4-methyl-6-(methylamino)pyrimidin-2-yl]morpholin-4-yl]-(2-methyl-1,3-oxazol-4-yl)methanone
CID 124967847
[(3S)-3-[4-methyl-6-(methylamino)pyrimidin-2-yl]morpholin-4-yl]-(1,3-thiazol-4-yl)methanone
CID 125023396
3-(3,5-dimethylphenoxy)-1-[3-(1,2,4-oxadiazol-3-yl)morpholin-4-yl]propan-1-one
CID 75470555

Frequently Asked Questions

What is the IUPAC name of 2-(dimethylamino)-1-[3-[4-(dimethylamino)-6-methylpyrimidin-2-yl]morpholin-4-yl]ethanone?
The IUPAC name of 2-(dimethylamino)-1-[3-[4-(dimethylamino)-6-methylpyrimidin-2-yl]morpholin-4-yl]ethanone (CID 110113853) is 2-(dimethylamino)-1-[3-[4-(dimethylamino)-6-methylpyrimidin-2-yl]morpholin-4-yl]ethanone.
What is the SMILES notation for 2-(dimethylamino)-1-[3-[4-(dimethylamino)-6-methylpyrimidin-2-yl]morpholin-4-yl]ethanone?
The canonical SMILES for 2-(dimethylamino)-1-[3-[4-(dimethylamino)-6-methylpyrimidin-2-yl]morpholin-4-yl]ethanone is Cc1cc(N(C)C)nc(C2COCCN2C(=O)CN(C)C)n1.
What is the InChIKey of 2-(dimethylamino)-1-[3-[4-(dimethylamino)-6-methylpyrimidin-2-yl]morpholin-4-yl]ethanone?
The InChIKey is GCAJVRJPLFPESW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N5O2/c1-11-8-13(19(4)5)17-15(16-11)12-10-22-7-6-20(12)14(21)9-18(2)3/h8,12H,6-7,9-10H2,1-5H3.
What are the key properties of 2-(dimethylamino)-1-[3-[4-(dimethylamino)-6-methylpyrimidin-2-yl]morpholin-4-yl]ethanone?
2-(dimethylamino)-1-[3-[4-(dimethylamino)-6-methylpyrimidin-2-yl]morpholin-4-yl]ethanone has a molecular weight of 307.40 g/mol, XLogP of 0.31, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(dimethylamino)-1-[3-[4-(dimethylamino)-6-methylpyrimidin-2-yl]morpholin-4-yl]ethanone is sourced from PubChem (CID 110113853), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).