2-fluoro-N,N,6-trimethyl-3-morpholin-4-ylbenzamide

C14H19FN2O2 — CID 23156760

IUPAC2-fluoro-N,N,6-trimethyl-3-morpholin-4-ylbenzamide
SMILESCc1ccc(N2CCOCC2)c(F)c1C(=O)N(C)C
InChIInChI=1S/C14H19FN2O2/c1-10-4-5-11(17-6-8-19-9-7-17)13(15)12(10)14(18)16(2)3/h4-5H,6-9H2,1-3H3
InChIKeyDQLAZAWQXTXSSX-UHFFFAOYSA-N
MW266.32 g/mol
LogP1.67
Rot. Bonds2

About 2-fluoro-N,N,6-trimethyl-3-morpholin-4-ylbenzamide

2-fluoro-N,N,6-trimethyl-3-morpholin-4-ylbenzamide (PubChem CID 23156760) has the molecular formula C14H19FN2O2 and a molecular weight of 266.32 g/mol. Its IUPAC name is 2-fluoro-N,N,6-trimethyl-3-morpholin-4-ylbenzamide.

Molecular Properties

Compound Name2-fluoro-N,N,6-trimethyl-3-morpholin-4-ylbenzamide
PubChem CID23156760
Molecular FormulaC14H19FN2O2
Molecular Weight266.32 g/mol
Exact Mass266.14
IUPAC Name2-fluoro-N,N,6-trimethyl-3-morpholin-4-ylbenzamide
SMILESCc1ccc(N2CCOCC2)c(F)c1C(=O)N(C)C
InChIInChI=1S/C14H19FN2O2/c1-10-4-5-11(17-6-8-19-9-7-17)13(15)12(10)14(18)16(2)3/h4-5H,6-9H2,1-3H3
InChIKeyDQLAZAWQXTXSSX-UHFFFAOYSA-N
XLogP1.67
TPSA32.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.32
LogP ≤ 51.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

lithium;3-methyl-4-morpholin-4-ylbenzoic acid;hydroxide
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CID 76936167
5-methyl-2-morpholin-4-ylbenzoic acid
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N-(5-fluoro-2-morpholin-4-ylphenyl)-2-methylbenzamide
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1-(2,3-difluoro-4-methylphenyl)pyrrolidine
CID 168515209
3-fluoro-N-methyl-4-morpholin-4-yl-N-[(3R)-pyrrolidin-3-yl]benzamide
CID 125147298
1-(3-fluoro-4-morpholin-4-ylphenyl)butan-1-one
CID 723653
3-[1-(5-fluoro-2-morpholin-4-ylphenyl)ethyl]-1-methyl-1-propan-2-ylurea
CID 86778801
methyl 3-methyl-4-morpholin-4-ylbenzoate
CID 67528858
1-(5-methyl-2-morpholin-4-ylphenyl)ethanone
CID 117312505
4-(2,3-difluoro-4-nitrophenyl)morpholine
CID 58072318
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CID 113092676

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-N,N,6-trimethyl-3-morpholin-4-ylbenzamide?
The IUPAC name of 2-fluoro-N,N,6-trimethyl-3-morpholin-4-ylbenzamide (CID 23156760) is 2-fluoro-N,N,6-trimethyl-3-morpholin-4-ylbenzamide.
What is the SMILES notation for 2-fluoro-N,N,6-trimethyl-3-morpholin-4-ylbenzamide?
The canonical SMILES for 2-fluoro-N,N,6-trimethyl-3-morpholin-4-ylbenzamide is Cc1ccc(N2CCOCC2)c(F)c1C(=O)N(C)C.
What is the InChIKey of 2-fluoro-N,N,6-trimethyl-3-morpholin-4-ylbenzamide?
The InChIKey is DQLAZAWQXTXSSX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19FN2O2/c1-10-4-5-11(17-6-8-19-9-7-17)13(15)12(10)14(18)16(2)3/h4-5H,6-9H2,1-3H3.
What are the key properties of 2-fluoro-N,N,6-trimethyl-3-morpholin-4-ylbenzamide?
2-fluoro-N,N,6-trimethyl-3-morpholin-4-ylbenzamide has a molecular weight of 266.32 g/mol, XLogP of 1.67, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-N,N,6-trimethyl-3-morpholin-4-ylbenzamide is sourced from PubChem (CID 23156760), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).