N-(3-ethylphenyl)morpholine-2-carboxamide;hydrochloride

C13H19ClN2O2 — CID 119675709

IUPACN-(3-ethylphenyl)morpholine-2-carboxamide;hydrochloride
SMILESCCc1cccc(NC(=O)C2CNCCO2)c1.Cl
InChIInChI=1S/C13H18N2O2.ClH/c1-2-10-4-3-5-11(8-10)15-13(16)12-9-14-6-7-17-12;/h3-5,8,12,14H,2,6-7,9H2,1H3,(H,15,16);1H
InChIKeyJJTXTBBBZWKBAK-UHFFFAOYSA-N
MW270.76 g/mol
LogP1.60
Rot. Bonds3

About N-(3-ethylphenyl)morpholine-2-carboxamide;hydrochloride

N-(3-ethylphenyl)morpholine-2-carboxamide;hydrochloride (PubChem CID 119675709) has the molecular formula C13H19ClN2O2 and a molecular weight of 270.76 g/mol. Its IUPAC name is N-(3-ethylphenyl)morpholine-2-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-(3-ethylphenyl)morpholine-2-carboxamide;hydrochloride
PubChem CID119675709
Molecular FormulaC13H19ClN2O2
Molecular Weight270.76 g/mol
Exact Mass270.11
IUPAC NameN-(3-ethylphenyl)morpholine-2-carboxamide;hydrochloride
SMILESCCc1cccc(NC(=O)C2CNCCO2)c1.Cl
InChIInChI=1S/C13H18N2O2.ClH/c1-2-10-4-3-5-11(8-10)15-13(16)12-9-14-6-7-17-12;/h3-5,8,12,14H,2,6-7,9H2,1H3,(H,15,16);1H
InChIKeyJJTXTBBBZWKBAK-UHFFFAOYSA-N
XLogP1.60
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.76
LogP ≤ 51.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[3-(2-butoxyethoxymethyl)phenyl]morpholine-2-carboxamide;hydrochloride
CID 119754344
N-[3-(tert-butylsulfinylmethyl)phenyl]morpholine-2-carboxamide
CID 119790021
N-[3-(ethylcarbamoylamino)phenyl]morpholine-2-carboxamide
CID 119755895
N-[3-(carbamoylamino)phenyl]morpholine-2-carboxamide;hydrochloride
CID 119702027
N-(3-butoxyphenyl)morpholine-2-carboxamide;hydrochloride
CID 119745760
N-[[3-(2-methylbutanoylamino)phenyl]methyl]morpholine-2-carboxamide;hydrochloride
CID 119716891
N-[[3-[(3-methylphenyl)carbamoylamino]phenyl]methyl]morpholine-2-carboxamide;hydrochloride
CID 119719704
N-[3-[(3-methylphenyl)methoxy]phenyl]morpholine-2-carboxamide
CID 119783770
N-[3-[(2-carbamoylpyrrolidin-1-yl)methyl]phenyl]morpholine-2-carboxamide;dihydrochloride
CID 119856261
N-(2-ethylphenyl)morpholine-2-carboxamide;hydrochloride
CID 119679075
N-(4-methylphenyl)morpholine-2-carboxamide;hydrochloride
CID 119670966
N-[[3-(pyrrolidine-1-carbonylamino)phenyl]methyl]morpholine-2-carboxamide;hydrochloride
CID 119743730

Frequently Asked Questions

What is the IUPAC name of N-(3-ethylphenyl)morpholine-2-carboxamide;hydrochloride?
The IUPAC name of N-(3-ethylphenyl)morpholine-2-carboxamide;hydrochloride (CID 119675709) is N-(3-ethylphenyl)morpholine-2-carboxamide;hydrochloride.
What is the SMILES notation for N-(3-ethylphenyl)morpholine-2-carboxamide;hydrochloride?
The canonical SMILES for N-(3-ethylphenyl)morpholine-2-carboxamide;hydrochloride is CCc1cccc(NC(=O)C2CNCCO2)c1.Cl.
What is the InChIKey of N-(3-ethylphenyl)morpholine-2-carboxamide;hydrochloride?
The InChIKey is JJTXTBBBZWKBAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N2O2.ClH/c1-2-10-4-3-5-11(8-10)15-13(16)12-9-14-6-7-17-12;/h3-5,8,12,14H,2,6-7,9H2,1H3,(H,15,16);1H.
What are the key properties of N-(3-ethylphenyl)morpholine-2-carboxamide;hydrochloride?
N-(3-ethylphenyl)morpholine-2-carboxamide;hydrochloride has a molecular weight of 270.76 g/mol, XLogP of 1.60, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-ethylphenyl)morpholine-2-carboxamide;hydrochloride is sourced from PubChem (CID 119675709), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).