2-methyl-6-(4-propan-2-ylmorpholin-2-yl)-1H-pyridin-4-one

C13H20N2O2 — CID 73439473

IUPAC2-methyl-6-(4-propan-2-ylmorpholin-2-yl)-1H-pyridin-4-one
SMILESCc1cc(=O)cc(C2CN(C(C)C)CCO2)[nH]1
InChIInChI=1S/C13H20N2O2/c1-9(2)15-4-5-17-13(8-15)12-7-11(16)6-10(3)14-12/h6-7,9,13H,4-5,8H2,1-3H3,(H,14,16)
InChIKeyBVRFAIHUNVDXBR-UHFFFAOYSA-N
MW236.31 g/mol
LogP1.47
Rot. Bonds2

About 2-methyl-6-(4-propan-2-ylmorpholin-2-yl)-1H-pyridin-4-one

2-methyl-6-(4-propan-2-ylmorpholin-2-yl)-1H-pyridin-4-one (PubChem CID 73439473) has the molecular formula C13H20N2O2 and a molecular weight of 236.31 g/mol. Its IUPAC name is 2-methyl-6-(4-propan-2-ylmorpholin-2-yl)-1H-pyridin-4-one.

Molecular Properties

Compound Name2-methyl-6-(4-propan-2-ylmorpholin-2-yl)-1H-pyridin-4-one
PubChem CID73439473
Molecular FormulaC13H20N2O2
Molecular Weight236.31 g/mol
Exact Mass236.15
IUPAC Name2-methyl-6-(4-propan-2-ylmorpholin-2-yl)-1H-pyridin-4-one
SMILESCc1cc(=O)cc(C2CN(C(C)C)CCO2)[nH]1
InChIInChI=1S/C13H20N2O2/c1-9(2)15-4-5-17-13(8-15)12-7-11(16)6-10(3)14-12/h6-7,9,13H,4-5,8H2,1-3H3,(H,14,16)
InChIKeyBVRFAIHUNVDXBR-UHFFFAOYSA-N
XLogP1.47
TPSA45.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.31
LogP ≤ 51.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3,4-Dihydro-2H-1,4-benzoxazin-6(8aH)-one
CID 129646596
2-methyl-6-morpholin-2-yl-1H-pyridin-4-one
CID 66510090
2-Methyl-6-(morpholin-2-yl)pyridin-4-ol dihydrochloride
CID 71298853
2-methyl-6-(4-methylmorpholin-2-yl)-1H-pyridin-4-one
CID 73440423
2,6-Dimethyl-1-(2-piperidin-4-yloxyethyl)pyridin-4-one
CID 79884499
2-methyl-6-[(2S)-morpholin-2-yl]-1H-pyridin-4-one
CID 92615143
2-methyl-6-[(2R)-morpholin-2-yl]-1H-pyridin-4-one
CID 92615144
2-methyl-6-[(2S)-4-propan-2-ylmorpholin-2-yl]-1H-pyridin-4-one
CID 95817237
2-methyl-6-[(2R)-4-propan-2-ylmorpholin-2-yl]-1H-pyridin-4-one
CID 95817238
2-[(2S)-4-acetylmorpholin-2-yl]-6-methyl-1H-pyridin-4-one
CID 95841385
2-[(2R)-4-acetylmorpholin-2-yl]-6-methyl-1H-pyridin-4-one
CID 95841386
2,6-Dimethyl-1-(morpholin-3-ylmethyl)pyridin-4-one
CID 103549618

Frequently Asked Questions

What is the IUPAC name of 2-methyl-6-(4-propan-2-ylmorpholin-2-yl)-1H-pyridin-4-one?
The IUPAC name of 2-methyl-6-(4-propan-2-ylmorpholin-2-yl)-1H-pyridin-4-one (CID 73439473) is 2-methyl-6-(4-propan-2-ylmorpholin-2-yl)-1H-pyridin-4-one.
What is the SMILES notation for 2-methyl-6-(4-propan-2-ylmorpholin-2-yl)-1H-pyridin-4-one?
The canonical SMILES for 2-methyl-6-(4-propan-2-ylmorpholin-2-yl)-1H-pyridin-4-one is Cc1cc(=O)cc(C2CN(C(C)C)CCO2)[nH]1.
What is the InChIKey of 2-methyl-6-(4-propan-2-ylmorpholin-2-yl)-1H-pyridin-4-one?
The InChIKey is BVRFAIHUNVDXBR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O2/c1-9(2)15-4-5-17-13(8-15)12-7-11(16)6-10(3)14-12/h6-7,9,13H,4-5,8H2,1-3H3,(H,14,16).
What are the key properties of 2-methyl-6-(4-propan-2-ylmorpholin-2-yl)-1H-pyridin-4-one?
2-methyl-6-(4-propan-2-ylmorpholin-2-yl)-1H-pyridin-4-one has a molecular weight of 236.31 g/mol, XLogP of 1.47, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-6-(4-propan-2-ylmorpholin-2-yl)-1H-pyridin-4-one is sourced from PubChem (CID 73439473), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).