[(2R)-2-ethylmorpholin-4-yl]-(3-fluoro-4-methoxyphenyl)methanone

C14H18FNO3 — CID 51934437

IUPAC[(2R)-2-ethylmorpholin-4-yl]-(3-fluoro-4-methoxyphenyl)methanone
SMILESCC[C@@H]1CN(C(=O)c2ccc(OC)c(F)c2)CCO1
InChIInChI=1S/C14H18FNO3/c1-3-11-9-16(6-7-19-11)14(17)10-4-5-13(18-2)12(15)8-10/h4-5,8,11H,3,6-7,9H2,1-2H3/t11-/m1/s1
InChIKeyYRSIEQGGBLZIGB-LLVKDONJSA-N
MW267.30 g/mol
LogP2.09
Rot. Bonds3

About [(2R)-2-ethylmorpholin-4-yl]-(3-fluoro-4-methoxyphenyl)methanone

[(2R)-2-ethylmorpholin-4-yl]-(3-fluoro-4-methoxyphenyl)methanone (PubChem CID 51934437) has the molecular formula C14H18FNO3 and a molecular weight of 267.30 g/mol. Its IUPAC name is [(2R)-2-ethylmorpholin-4-yl]-(3-fluoro-4-methoxyphenyl)methanone.

Molecular Properties

Compound Name[(2R)-2-ethylmorpholin-4-yl]-(3-fluoro-4-methoxyphenyl)methanone
PubChem CID51934437
Molecular FormulaC14H18FNO3
Molecular Weight267.30 g/mol
Exact Mass267.13
IUPAC Name[(2R)-2-ethylmorpholin-4-yl]-(3-fluoro-4-methoxyphenyl)methanone
SMILESCC[C@@H]1CN(C(=O)c2ccc(OC)c(F)c2)CCO1
InChIInChI=1S/C14H18FNO3/c1-3-11-9-16(6-7-19-11)14(17)10-4-5-13(18-2)12(15)8-10/h4-5,8,11H,3,6-7,9H2,1-2H3/t11-/m1/s1
InChIKeyYRSIEQGGBLZIGB-LLVKDONJSA-N
XLogP2.09
TPSA38.77 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.30
LogP ≤ 52.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

(3-fluoro-4-methoxyphenyl)-[(2R)-2-(2-pyrimidin-4-ylethyl)morpholin-4-yl]methanone
CID 124944270
4-(3-fluoro-4-methoxybenzoyl)morpholine-2-carbothioamide
CID 79675182
[2-(chloromethyl)morpholin-4-yl]-(3,4-dimethoxyphenyl)methanone
CID 81210339
(4-bromo-3-methylphenyl)-(2-ethylmorpholin-4-yl)methanone
CID 112705730
1,3-benzodioxol-5-yl-(2-ethylmorpholin-4-yl)methanone
CID 43070650
(3,4-dimethoxyphenyl)-[2-[(3-fluorophenyl)methyl]morpholin-4-yl]methanone
CID 45238113
3-(2-ethylmorpholine-4-carbonyl)benzoic acid
CID 43563067
(3-chloropyrrolidin-1-yl)-(3-fluoro-4-methoxyphenyl)methanone
CID 63394230
(2-ethylmorpholin-4-yl)-(4-sulfanylphenyl)methanone
CID 107023047
(4-bromo-2-methoxyphenyl)-(2-ethylmorpholin-4-yl)methanone
CID 78988641
2-[4-(3-fluoro-4-methylbenzoyl)morpholin-2-yl]acetic acid
CID 66421551
(3-fluoro-4-methoxyphenyl)-[3-(1-hydroxyethyl)pyrrolidin-1-yl]methanone
CID 112627165

Frequently Asked Questions

What is the IUPAC name of [(2R)-2-ethylmorpholin-4-yl]-(3-fluoro-4-methoxyphenyl)methanone?
The IUPAC name of [(2R)-2-ethylmorpholin-4-yl]-(3-fluoro-4-methoxyphenyl)methanone (CID 51934437) is [(2R)-2-ethylmorpholin-4-yl]-(3-fluoro-4-methoxyphenyl)methanone.
What is the SMILES notation for [(2R)-2-ethylmorpholin-4-yl]-(3-fluoro-4-methoxyphenyl)methanone?
The canonical SMILES for [(2R)-2-ethylmorpholin-4-yl]-(3-fluoro-4-methoxyphenyl)methanone is CC[C@@H]1CN(C(=O)c2ccc(OC)c(F)c2)CCO1.
What is the InChIKey of [(2R)-2-ethylmorpholin-4-yl]-(3-fluoro-4-methoxyphenyl)methanone?
The InChIKey is YRSIEQGGBLZIGB-LLVKDONJSA-N. The full InChI is InChI=1S/C14H18FNO3/c1-3-11-9-16(6-7-19-11)14(17)10-4-5-13(18-2)12(15)8-10/h4-5,8,11H,3,6-7,9H2,1-2H3/t11-/m1/s1.
What are the key properties of [(2R)-2-ethylmorpholin-4-yl]-(3-fluoro-4-methoxyphenyl)methanone?
[(2R)-2-ethylmorpholin-4-yl]-(3-fluoro-4-methoxyphenyl)methanone has a molecular weight of 267.30 g/mol, XLogP of 2.09, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(2R)-2-ethylmorpholin-4-yl]-(3-fluoro-4-methoxyphenyl)methanone is sourced from PubChem (CID 51934437), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).