(2-ethylpiperidin-1-yl)-(2-methyl-6-morpholin-4-ylpyrimidin-4-yl)methanone

C17H26N4O2 — CID 109365400

IUPAC(2-ethylpiperidin-1-yl)-(2-methyl-6-morpholin-4-ylpyrimidin-4-yl)methanone
SMILESCCC1CCCCN1C(=O)c1cc(N2CCOCC2)nc(C)n1
InChIInChI=1S/C17H26N4O2/c1-3-14-6-4-5-7-21(14)17(22)15-12-16(19-13(2)18-15)20-8-10-23-11-9-20/h12,14H,3-11H2,1-2H3
InChIKeyDRSMOZFDGVCGEG-UHFFFAOYSA-N
MW318.42 g/mol
LogP2.03
Rot. Bonds3

About (2-ethylpiperidin-1-yl)-(2-methyl-6-morpholin-4-ylpyrimidin-4-yl)methanone

(2-ethylpiperidin-1-yl)-(2-methyl-6-morpholin-4-ylpyrimidin-4-yl)methanone (PubChem CID 109365400) has the molecular formula C17H26N4O2 and a molecular weight of 318.42 g/mol. Its IUPAC name is (2-ethylpiperidin-1-yl)-(2-methyl-6-morpholin-4-ylpyrimidin-4-yl)methanone.

Molecular Properties

Compound Name(2-ethylpiperidin-1-yl)-(2-methyl-6-morpholin-4-ylpyrimidin-4-yl)methanone
PubChem CID109365400
Molecular FormulaC17H26N4O2
Molecular Weight318.42 g/mol
Exact Mass318.21
IUPAC Name(2-ethylpiperidin-1-yl)-(2-methyl-6-morpholin-4-ylpyrimidin-4-yl)methanone
SMILESCCC1CCCCN1C(=O)c1cc(N2CCOCC2)nc(C)n1
InChIInChI=1S/C17H26N4O2/c1-3-14-6-4-5-7-21(14)17(22)15-12-16(19-13(2)18-15)20-8-10-23-11-9-20/h12,14H,3-11H2,1-2H3
InChIKeyDRSMOZFDGVCGEG-UHFFFAOYSA-N
XLogP2.03
TPSA58.56 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.42
LogP ≤ 52.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

[6-(2-ethylpiperidin-1-yl)-2-methylpyrimidin-4-yl]-morpholin-4-ylmethanone
CID 109365565
(2-ethylpiperidin-1-yl)-(5-morpholin-4-ylpyrazin-2-yl)methanone
CID 109276634
(2-ethylpiperidin-1-yl)-[2-methyl-6-(2-morpholin-4-ylethylamino)pyrimidin-4-yl]methanone
CID 109366377
[6-(diethylamino)-2-methylpyrimidin-4-yl]-(2-ethylpiperidin-1-yl)methanone
CID 109373283
(6-anilino-2-methylpyrimidin-4-yl)-(2-ethylpiperidin-1-yl)methanone
CID 112847218
(2-ethylpiperidin-1-yl)-[6-methyl-2-(2-morpholin-4-ylethylamino)pyrimidin-4-yl]methanone
CID 109325229
[6-[(2S)-2-ethylpiperidine-1-carbonyl]-2-pyridinyl]-[(2S)-2-ethylpiperidin-1-yl]methanone
CID 40585097
[2-(2-hydroxyethyl)piperidin-1-yl]-(6-morpholin-4-yl-2-pyridinyl)methanone
CID 84574009
[2-methyl-6-(3-methylpiperidin-1-yl)pyrimidin-4-yl]-morpholin-4-ylmethanone
CID 75538840
(4-benzylpiperidin-1-yl)-(2-methyl-6-morpholin-4-ylpyrimidin-4-yl)methanone
CID 109365399
[6-(4-chloro-2-methylanilino)-2-methylpyrimidin-4-yl]-(2-ethylpiperidin-1-yl)methanone
CID 112847243
(2-ethylpiperidin-1-yl)-[2-methyl-6-(2,3,4-trifluoroanilino)pyrimidin-4-yl]methanone
CID 112847284

Frequently Asked Questions

What is the IUPAC name of (2-ethylpiperidin-1-yl)-(2-methyl-6-morpholin-4-ylpyrimidin-4-yl)methanone?
The IUPAC name of (2-ethylpiperidin-1-yl)-(2-methyl-6-morpholin-4-ylpyrimidin-4-yl)methanone (CID 109365400) is (2-ethylpiperidin-1-yl)-(2-methyl-6-morpholin-4-ylpyrimidin-4-yl)methanone.
What is the SMILES notation for (2-ethylpiperidin-1-yl)-(2-methyl-6-morpholin-4-ylpyrimidin-4-yl)methanone?
The canonical SMILES for (2-ethylpiperidin-1-yl)-(2-methyl-6-morpholin-4-ylpyrimidin-4-yl)methanone is CCC1CCCCN1C(=O)c1cc(N2CCOCC2)nc(C)n1.
What is the InChIKey of (2-ethylpiperidin-1-yl)-(2-methyl-6-morpholin-4-ylpyrimidin-4-yl)methanone?
The InChIKey is DRSMOZFDGVCGEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N4O2/c1-3-14-6-4-5-7-21(14)17(22)15-12-16(19-13(2)18-15)20-8-10-23-11-9-20/h12,14H,3-11H2,1-2H3.
What are the key properties of (2-ethylpiperidin-1-yl)-(2-methyl-6-morpholin-4-ylpyrimidin-4-yl)methanone?
(2-ethylpiperidin-1-yl)-(2-methyl-6-morpholin-4-ylpyrimidin-4-yl)methanone has a molecular weight of 318.42 g/mol, XLogP of 2.03, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2-ethylpiperidin-1-yl)-(2-methyl-6-morpholin-4-ylpyrimidin-4-yl)methanone is sourced from PubChem (CID 109365400), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).