N-methyl-N-(4-methylphenyl)morpholine-2-carboxamide;hydrochloride

C13H19ClN2O2 — CID 119706070

IUPACN-methyl-N-(4-methylphenyl)morpholine-2-carboxamide;hydrochloride
SMILESCc1ccc(N(C)C(=O)C2CNCCO2)cc1.Cl
InChIInChI=1S/C13H18N2O2.ClH/c1-10-3-5-11(6-4-10)15(2)13(16)12-9-14-7-8-17-12;/h3-6,12,14H,7-9H2,1-2H3;1H
InChIKeySRKBYBYJKMMCQX-UHFFFAOYSA-N
MW270.76 g/mol
LogP1.37
Rot. Bonds2

About N-methyl-N-(4-methylphenyl)morpholine-2-carboxamide;hydrochloride

N-methyl-N-(4-methylphenyl)morpholine-2-carboxamide;hydrochloride (PubChem CID 119706070) has the molecular formula C13H19ClN2O2 and a molecular weight of 270.76 g/mol. Its IUPAC name is N-methyl-N-(4-methylphenyl)morpholine-2-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-methyl-N-(4-methylphenyl)morpholine-2-carboxamide;hydrochloride
PubChem CID119706070
Molecular FormulaC13H19ClN2O2
Molecular Weight270.76 g/mol
Exact Mass270.11
IUPAC NameN-methyl-N-(4-methylphenyl)morpholine-2-carboxamide;hydrochloride
SMILESCc1ccc(N(C)C(=O)C2CNCCO2)cc1.Cl
InChIInChI=1S/C13H18N2O2.ClH/c1-10-3-5-11(6-4-10)15(2)13(16)12-9-14-7-8-17-12;/h3-6,12,14H,7-9H2,1-2H3;1H
InChIKeySRKBYBYJKMMCQX-UHFFFAOYSA-N
XLogP1.37
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.76
LogP ≤ 51.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-chlorophenyl)-N-methylmorpholine-2-carboxamide
CID 115177410
N-methyl-N-(3-methylphenyl)morpholine-2-carboxamide;hydrochloride
CID 119707893
N-(3-bromophenyl)-N-methylmorpholine-2-carboxamide
CID 115177440
N,N-dimethylmorpholine-2-carboxamide;hydrochloride
CID 71298970
N-(4-methylphenyl)morpholine-2-carboxamide;hydrochloride
CID 119670966
N,N-dimethylmorpholine-2-carboxamide;ethane
CID 144883589
(2S)-N-methyl-N-propan-2-ylmorpholine-2-carboxamide;hydrochloride
CID 131067526
N-(6-chloropyrimidin-4-yl)-N-methylmorpholine-2-carboxamide
CID 126486008
N-[(2-bromophenyl)methyl]-N-methylmorpholine-2-carboxamide;hydrochloride
CID 119681071
N-methyl-N-[1-(4-methylphenyl)ethyl]-2-morpholin-2-ylacetamide;hydrochloride
CID 119717401
N-[methoxy(dimethyl)silyl]-N-methylmorpholine-2-carboxamide
CID 69339522
N-[[4-[methyl(pyridine-4-carbonyl)amino]phenyl]methyl]morpholine-2-carboxamide;dihydrochloride
CID 119887029

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(4-methylphenyl)morpholine-2-carboxamide;hydrochloride?
The IUPAC name of N-methyl-N-(4-methylphenyl)morpholine-2-carboxamide;hydrochloride (CID 119706070) is N-methyl-N-(4-methylphenyl)morpholine-2-carboxamide;hydrochloride.
What is the SMILES notation for N-methyl-N-(4-methylphenyl)morpholine-2-carboxamide;hydrochloride?
The canonical SMILES for N-methyl-N-(4-methylphenyl)morpholine-2-carboxamide;hydrochloride is Cc1ccc(N(C)C(=O)C2CNCCO2)cc1.Cl.
What is the InChIKey of N-methyl-N-(4-methylphenyl)morpholine-2-carboxamide;hydrochloride?
The InChIKey is SRKBYBYJKMMCQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N2O2.ClH/c1-10-3-5-11(6-4-10)15(2)13(16)12-9-14-7-8-17-12;/h3-6,12,14H,7-9H2,1-2H3;1H.
What are the key properties of N-methyl-N-(4-methylphenyl)morpholine-2-carboxamide;hydrochloride?
N-methyl-N-(4-methylphenyl)morpholine-2-carboxamide;hydrochloride has a molecular weight of 270.76 g/mol, XLogP of 1.37, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(4-methylphenyl)morpholine-2-carboxamide;hydrochloride is sourced from PubChem (CID 119706070), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).