N-methyl-N-[(2-methylphenyl)methyl]morpholine-3-carboxamide;hydrochloride

C14H21ClN2O2 — CID 119681680

IUPACN-methyl-N-[(2-methylphenyl)methyl]morpholine-3-carboxamide;hydrochloride
SMILESCc1ccccc1CN(C)C(=O)C1COCCN1.Cl
InChIInChI=1S/C14H20N2O2.ClH/c1-11-5-3-4-6-12(11)9-16(2)14(17)13-10-18-8-7-15-13;/h3-6,13,15H,7-10H2,1-2H3;1H
InChIKeyBXUNEEJCQPRBSP-UHFFFAOYSA-N
MW284.79 g/mol
LogP1.36
Rot. Bonds3

About N-methyl-N-[(2-methylphenyl)methyl]morpholine-3-carboxamide;hydrochloride

N-methyl-N-[(2-methylphenyl)methyl]morpholine-3-carboxamide;hydrochloride (PubChem CID 119681680) has the molecular formula C14H21ClN2O2 and a molecular weight of 284.79 g/mol. Its IUPAC name is N-methyl-N-[(2-methylphenyl)methyl]morpholine-3-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-methyl-N-[(2-methylphenyl)methyl]morpholine-3-carboxamide;hydrochloride
PubChem CID119681680
Molecular FormulaC14H21ClN2O2
Molecular Weight284.79 g/mol
Exact Mass284.13
IUPAC NameN-methyl-N-[(2-methylphenyl)methyl]morpholine-3-carboxamide;hydrochloride
SMILESCc1ccccc1CN(C)C(=O)C1COCCN1.Cl
InChIInChI=1S/C14H20N2O2.ClH/c1-11-5-3-4-6-12(11)9-16(2)14(17)13-10-18-8-7-15-13;/h3-6,13,15H,7-10H2,1-2H3;1H
InChIKeyBXUNEEJCQPRBSP-UHFFFAOYSA-N
XLogP1.36
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.79
LogP ≤ 51.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-methyl-N-[(2-methylphenyl)methyl]morpholine-3-carboxamide;hydrochloride with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[(2,3-dichlorophenyl)methyl]-N-methylmorpholine-3-carboxamide;hydrochloride
CID 119682446
N-[(4,5-dimethoxy-2-methylphenyl)methyl]-N-methylmorpholine-3-carboxamide;hydrochloride
CID 119690480
(2R)-N-methyl-N-[(2-methylphenyl)methyl]pyrrolidine-2-carboxamide
CID 93042188
(3R)-N-methyl-N-[2-(2-methylphenoxy)ethyl]morpholine-3-carboxamide
CID 124513206
N-methyl-N-[(2-methylphenyl)methyl]-1,3-thiazolidine-4-carboxamide
CID 43579156
N,4-dimethyl-N-[(2-methylphenyl)methyl]piperazine-2-carboxamide
CID 115178034
N-methyl-N-[(2-methylphenyl)methyl]-1,2,3,4-tetrahydroisoquinoline-3-carboxamide;hydrochloride
CID 119267102
N-methyl-N-[(1-phenylpyrazol-4-yl)methyl]morpholine-3-carboxamide
CID 119694754
N-methyl-N-[2-(5-methylfuran-2-yl)ethyl]morpholine-3-carboxamide
CID 115177679
N-[2-(4-fluorophenyl)ethyl]-N-methylmorpholine-3-carboxamide
CID 115177667
N-methyl-N-(2,4,6-trimethylphenyl)morpholine-3-carboxamide
CID 115177590
N-(2-bromophenyl)-N-methylmorpholine-3-carboxamide
CID 115177610

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[(2-methylphenyl)methyl]morpholine-3-carboxamide;hydrochloride?
The IUPAC name of N-methyl-N-[(2-methylphenyl)methyl]morpholine-3-carboxamide;hydrochloride (CID 119681680) is N-methyl-N-[(2-methylphenyl)methyl]morpholine-3-carboxamide;hydrochloride.
What is the SMILES notation for N-methyl-N-[(2-methylphenyl)methyl]morpholine-3-carboxamide;hydrochloride?
The canonical SMILES for N-methyl-N-[(2-methylphenyl)methyl]morpholine-3-carboxamide;hydrochloride is Cc1ccccc1CN(C)C(=O)C1COCCN1.Cl.
What is the InChIKey of N-methyl-N-[(2-methylphenyl)methyl]morpholine-3-carboxamide;hydrochloride?
The InChIKey is BXUNEEJCQPRBSP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O2.ClH/c1-11-5-3-4-6-12(11)9-16(2)14(17)13-10-18-8-7-15-13;/h3-6,13,15H,7-10H2,1-2H3;1H.
What are the key properties of N-methyl-N-[(2-methylphenyl)methyl]morpholine-3-carboxamide;hydrochloride?
N-methyl-N-[(2-methylphenyl)methyl]morpholine-3-carboxamide;hydrochloride has a molecular weight of 284.79 g/mol, XLogP of 1.36, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[(2-methylphenyl)methyl]morpholine-3-carboxamide;hydrochloride is sourced from PubChem (CID 119681680), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).