N-[1-(2-methylphenyl)ethyl]morpholine-2-carboxamide;hydrochloride

C14H21ClN2O2 — CID 119686063

IUPACN-[1-(2-methylphenyl)ethyl]morpholine-2-carboxamide;hydrochloride
SMILESCc1ccccc1C(C)NC(=O)C1CNCCO1.Cl
InChIInChI=1S/C14H20N2O2.ClH/c1-10-5-3-4-6-12(10)11(2)16-14(17)13-9-15-7-8-18-13;/h3-6,11,13,15H,7-9H2,1-2H3,(H,16,17);1H
InChIKeyCAPFOVVLPIXRBO-UHFFFAOYSA-N
MW284.79 g/mol
LogP1.58
Rot. Bonds3

About N-[1-(2-methylphenyl)ethyl]morpholine-2-carboxamide;hydrochloride

N-[1-(2-methylphenyl)ethyl]morpholine-2-carboxamide;hydrochloride (PubChem CID 119686063) has the molecular formula C14H21ClN2O2 and a molecular weight of 284.79 g/mol. Its IUPAC name is N-[1-(2-methylphenyl)ethyl]morpholine-2-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-[1-(2-methylphenyl)ethyl]morpholine-2-carboxamide;hydrochloride
PubChem CID119686063
Molecular FormulaC14H21ClN2O2
Molecular Weight284.79 g/mol
Exact Mass284.13
IUPAC NameN-[1-(2-methylphenyl)ethyl]morpholine-2-carboxamide;hydrochloride
SMILESCc1ccccc1C(C)NC(=O)C1CNCCO1.Cl
InChIInChI=1S/C14H20N2O2.ClH/c1-10-5-3-4-6-12(10)11(2)16-14(17)13-9-15-7-8-18-13;/h3-6,11,13,15H,7-9H2,1-2H3,(H,16,17);1H
InChIKeyCAPFOVVLPIXRBO-UHFFFAOYSA-N
XLogP1.58
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.79
LogP ≤ 51.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-methyl-1-(2-methylphenyl)propyl]morpholine-2-carboxamide
CID 119782789
N-[(1S)-1-naphthalen-1-ylethyl]morpholine-2-carboxamide
CID 146426620
N-[1-(2,4-difluorophenyl)ethyl]morpholine-2-carboxamide;hydrochloride
CID 119686288
N-[(1S)-1-(furan-2-yl)ethyl]morpholine-2-carboxamide
CID 81400797
(3S)-N-[1-(2-methylphenyl)ethyl]piperidine-3-carboxamide
CID 81140463
N-[(1R)-1-pyridin-2-ylethyl]morpholine-2-carboxamide
CID 81407111
N-[(1R)-1-thiophen-2-ylethyl]morpholine-2-carboxamide
CID 81408817
N-[1-[4-(phenylcarbamoylamino)phenyl]ethyl]morpholine-2-carboxamide;hydrochloride
CID 119722017
N-[1-(3-chlorophenyl)ethyl]morpholine-2-carboxamide;hydrochloride
CID 119685359
(2R,5S)-5-[1-(2-methylphenyl)ethylcarbamoyl]oxolane-2-carboxylic acid
CID 102944480
N-[(1R)-1-(3-chlorophenyl)ethyl]morpholine-2-carboxamide
CID 81372205
N-[1-[4-(2-methylpropyl)phenyl]ethyl]morpholine-2-carboxamide;hydrochloride
CID 119683082

Frequently Asked Questions

What is the IUPAC name of N-[1-(2-methylphenyl)ethyl]morpholine-2-carboxamide;hydrochloride?
The IUPAC name of N-[1-(2-methylphenyl)ethyl]morpholine-2-carboxamide;hydrochloride (CID 119686063) is N-[1-(2-methylphenyl)ethyl]morpholine-2-carboxamide;hydrochloride.
What is the SMILES notation for N-[1-(2-methylphenyl)ethyl]morpholine-2-carboxamide;hydrochloride?
The canonical SMILES for N-[1-(2-methylphenyl)ethyl]morpholine-2-carboxamide;hydrochloride is Cc1ccccc1C(C)NC(=O)C1CNCCO1.Cl.
What is the InChIKey of N-[1-(2-methylphenyl)ethyl]morpholine-2-carboxamide;hydrochloride?
The InChIKey is CAPFOVVLPIXRBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O2.ClH/c1-10-5-3-4-6-12(10)11(2)16-14(17)13-9-15-7-8-18-13;/h3-6,11,13,15H,7-9H2,1-2H3,(H,16,17);1H.
What are the key properties of N-[1-(2-methylphenyl)ethyl]morpholine-2-carboxamide;hydrochloride?
N-[1-(2-methylphenyl)ethyl]morpholine-2-carboxamide;hydrochloride has a molecular weight of 284.79 g/mol, XLogP of 1.58, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(2-methylphenyl)ethyl]morpholine-2-carboxamide;hydrochloride is sourced from PubChem (CID 119686063), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).