N-(2-fluoro-5-methoxyphenyl)morpholine-3-carboxamide;hydrochloride

C12H16ClFN2O3 — CID 119788904

IUPACN-(2-fluoro-5-methoxyphenyl)morpholine-3-carboxamide;hydrochloride
SMILESCOc1ccc(F)c(NC(=O)C2COCCN2)c1.Cl
InChIInChI=1S/C12H15FN2O3.ClH/c1-17-8-2-3-9(13)10(6-8)15-12(16)11-7-18-5-4-14-11;/h2-3,6,11,14H,4-5,7H2,1H3,(H,15,16);1H
InChIKeyKWQBTXDFWCESEO-UHFFFAOYSA-N
MW290.72 g/mol
LogP1.18
Rot. Bonds3

About N-(2-fluoro-5-methoxyphenyl)morpholine-3-carboxamide;hydrochloride

N-(2-fluoro-5-methoxyphenyl)morpholine-3-carboxamide;hydrochloride (PubChem CID 119788904) has the molecular formula C12H16ClFN2O3 and a molecular weight of 290.72 g/mol. Its IUPAC name is N-(2-fluoro-5-methoxyphenyl)morpholine-3-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-(2-fluoro-5-methoxyphenyl)morpholine-3-carboxamide;hydrochloride
PubChem CID119788904
Molecular FormulaC12H16ClFN2O3
Molecular Weight290.72 g/mol
Exact Mass290.08
IUPAC NameN-(2-fluoro-5-methoxyphenyl)morpholine-3-carboxamide;hydrochloride
SMILESCOc1ccc(F)c(NC(=O)C2COCCN2)c1.Cl
InChIInChI=1S/C12H15FN2O3.ClH/c1-17-8-2-3-9(13)10(6-8)15-12(16)11-7-18-5-4-14-11;/h2-3,6,11,14H,4-5,7H2,1H3,(H,15,16);1H
InChIKeyKWQBTXDFWCESEO-UHFFFAOYSA-N
XLogP1.18
TPSA59.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.72
LogP ≤ 51.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

(2R)-N-(2-fluoro-5-methoxyphenyl)pyrrolidine-2-carboxamide
CID 113264214
N-(4,5-dimethoxy-2-methylphenyl)morpholine-3-carboxamide;hydrochloride
CID 119679081
N-(2-fluoro-5-methoxyphenyl)piperidine-2-carboxamide;2,2,2-trifluoroacetic acid
CID 167828177
N-(4-methoxy-2,3-dimethylphenyl)morpholine-3-carboxamide
CID 115177555
N-(3,4-dimethoxyphenyl)morpholine-3-carboxamide;hydrochloride
CID 119673632
N-[2-(4-methoxyphenoxy)ethyl]morpholine-3-carboxamide;hydrochloride
CID 119694151
N-(3,5-difluoro-4-iodophenyl)morpholine-3-carboxamide;hydrochloride
CID 119764589
N-[2-fluoro-5-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-yl)phenyl]morpholine-3-carboxamide;dihydrochloride
CID 119841733
(3S)-N-(2-hydroxyphenyl)morpholine-3-carboxamide
CID 96998659
N-(3,5-difluoro-4-iodophenyl)morpholine-3-carboxamide
CID 119764590
N-(4-phenoxyphenyl)morpholine-3-carboxamide;hydrochloride
CID 75422319
N-(2-tert-butylphenyl)morpholine-3-carboxamide;hydrochloride
CID 119399897

Frequently Asked Questions

What is the IUPAC name of N-(2-fluoro-5-methoxyphenyl)morpholine-3-carboxamide;hydrochloride?
The IUPAC name of N-(2-fluoro-5-methoxyphenyl)morpholine-3-carboxamide;hydrochloride (CID 119788904) is N-(2-fluoro-5-methoxyphenyl)morpholine-3-carboxamide;hydrochloride.
What is the SMILES notation for N-(2-fluoro-5-methoxyphenyl)morpholine-3-carboxamide;hydrochloride?
The canonical SMILES for N-(2-fluoro-5-methoxyphenyl)morpholine-3-carboxamide;hydrochloride is COc1ccc(F)c(NC(=O)C2COCCN2)c1.Cl.
What is the InChIKey of N-(2-fluoro-5-methoxyphenyl)morpholine-3-carboxamide;hydrochloride?
The InChIKey is KWQBTXDFWCESEO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15FN2O3.ClH/c1-17-8-2-3-9(13)10(6-8)15-12(16)11-7-18-5-4-14-11;/h2-3,6,11,14H,4-5,7H2,1H3,(H,15,16);1H.
What are the key properties of N-(2-fluoro-5-methoxyphenyl)morpholine-3-carboxamide;hydrochloride?
N-(2-fluoro-5-methoxyphenyl)morpholine-3-carboxamide;hydrochloride has a molecular weight of 290.72 g/mol, XLogP of 1.18, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-fluoro-5-methoxyphenyl)morpholine-3-carboxamide;hydrochloride is sourced from PubChem (CID 119788904), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).