8-methyl-6-[[(2R)-2-methylmorpholin-4-yl]methyl]chromen-4-one

C16H19NO3 — CID 172610136

IUPAC8-methyl-6-[[(2R)-2-methylmorpholin-4-yl]methyl]chromen-4-one
SMILESCc1cc(CN2CCO[C@H](C)C2)cc2c(=O)ccoc12
InChIInChI=1S/C16H19NO3/c1-11-7-13(10-17-4-6-19-12(2)9-17)8-14-15(18)3-5-20-16(11)14/h3,5,7-8,12H,4,6,9-10H2,1-2H3/t12-/m1/s1
InChIKeyUIRRYAMKVUZIIF-GFCCVEGCSA-N
MW273.33 g/mol
LogP2.32
Rot. Bonds2

About 8-methyl-6-[[(2R)-2-methylmorpholin-4-yl]methyl]chromen-4-one

8-methyl-6-[[(2R)-2-methylmorpholin-4-yl]methyl]chromen-4-one (PubChem CID 172610136) has the molecular formula C16H19NO3 and a molecular weight of 273.33 g/mol. Its IUPAC name is 8-methyl-6-[[(2R)-2-methylmorpholin-4-yl]methyl]chromen-4-one.

Molecular Properties

Compound Name8-methyl-6-[[(2R)-2-methylmorpholin-4-yl]methyl]chromen-4-one
PubChem CID172610136
Molecular FormulaC16H19NO3
Molecular Weight273.33 g/mol
Exact Mass273.14
IUPAC Name8-methyl-6-[[(2R)-2-methylmorpholin-4-yl]methyl]chromen-4-one
SMILESCc1cc(CN2CCO[C@H](C)C2)cc2c(=O)ccoc12
InChIInChI=1S/C16H19NO3/c1-11-7-13(10-17-4-6-19-12(2)9-17)8-14-15(18)3-5-20-16(11)14/h3,5,7-8,12H,4,6,9-10H2,1-2H3/t12-/m1/s1
InChIKeyUIRRYAMKVUZIIF-GFCCVEGCSA-N
XLogP2.32
TPSA42.68 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.33
LogP ≤ 52.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

2-methyl-4-(1,2-oxazol-5-ylmethyl)morpholine
CID 130668586
4-[(1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)methyl]-2-methylmorpholine
CID 87015309
4-[(5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)methyl]-2-methylmorpholine
CID 134055216
4-[(4-chloro-3-nitrophenyl)methyl]-2-methylmorpholine
CID 43350266
4-(2,3-dihydro-1H-indol-6-ylmethyl)-2-methylmorpholine
CID 113382511
N-[[3-[(2-methylmorpholin-4-yl)methyl]phenyl]methyl]ethanamine
CID 62439094
4-[(2-chloro-4-pyridinyl)methyl]-2-methyl-1,4-oxazepane
CID 62988182
3-[6-cyclopropyl-4-[(R)-cyclopropyl-fluoro-(4-methyl-1,2,4-triazol-3-yl)methyl]-2-pyridinyl]-8-methyl-6-[[(2R)-2-methylmorpholin-4-yl]methyl]chromen-4-one
CID 172610094
(4R)-N-[[3-[[(2R)-2-methylmorpholin-4-yl]methyl]phenyl]methyl]-2-oxoimidazolidine-4-carboxamide
CID 98798763
3-[(2-methylmorpholin-4-yl)methyl]benzohydrazide
CID 63569378
4-[(3-bromo-4-methoxyphenyl)methyl]-2-methylmorpholine
CID 60705276
4-[(3-fluoro-4-methoxyphenyl)methyl]-2-methylmorpholine
CID 51074764

Frequently Asked Questions

What is the IUPAC name of 8-methyl-6-[[(2R)-2-methylmorpholin-4-yl]methyl]chromen-4-one?
The IUPAC name of 8-methyl-6-[[(2R)-2-methylmorpholin-4-yl]methyl]chromen-4-one (CID 172610136) is 8-methyl-6-[[(2R)-2-methylmorpholin-4-yl]methyl]chromen-4-one.
What is the SMILES notation for 8-methyl-6-[[(2R)-2-methylmorpholin-4-yl]methyl]chromen-4-one?
The canonical SMILES for 8-methyl-6-[[(2R)-2-methylmorpholin-4-yl]methyl]chromen-4-one is Cc1cc(CN2CCO[C@H](C)C2)cc2c(=O)ccoc12.
What is the InChIKey of 8-methyl-6-[[(2R)-2-methylmorpholin-4-yl]methyl]chromen-4-one?
The InChIKey is UIRRYAMKVUZIIF-GFCCVEGCSA-N. The full InChI is InChI=1S/C16H19NO3/c1-11-7-13(10-17-4-6-19-12(2)9-17)8-14-15(18)3-5-20-16(11)14/h3,5,7-8,12H,4,6,9-10H2,1-2H3/t12-/m1/s1.
What are the key properties of 8-methyl-6-[[(2R)-2-methylmorpholin-4-yl]methyl]chromen-4-one?
8-methyl-6-[[(2R)-2-methylmorpholin-4-yl]methyl]chromen-4-one has a molecular weight of 273.33 g/mol, XLogP of 2.32, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 8-methyl-6-[[(2R)-2-methylmorpholin-4-yl]methyl]chromen-4-one is sourced from PubChem (CID 172610136), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).