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

C13H18N2O2 — CID 116655392

IUPACN-methyl-N-(2-methylphenyl)morpholine-4-carboxamide
SMILESCc1ccccc1N(C)C(=O)N1CCOCC1
InChIInChI=1S/C13H18N2O2/c1-11-5-3-4-6-12(11)14(2)13(16)15-7-9-17-10-8-15/h3-6H,7-10H2,1-2H3
InChIKeyHNRHLDBSDIXIRW-UHFFFAOYSA-N
MW234.30 g/mol
LogP1.88
Rot. Bonds1

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

N-methyl-N-(2-methylphenyl)morpholine-4-carboxamide (PubChem CID 116655392) has the molecular formula C13H18N2O2 and a molecular weight of 234.30 g/mol. Its IUPAC name is N-methyl-N-(2-methylphenyl)morpholine-4-carboxamide.

Molecular Properties

Compound NameN-methyl-N-(2-methylphenyl)morpholine-4-carboxamide
PubChem CID116655392
Molecular FormulaC13H18N2O2
Molecular Weight234.30 g/mol
Exact Mass234.14
IUPAC NameN-methyl-N-(2-methylphenyl)morpholine-4-carboxamide
SMILESCc1ccccc1N(C)C(=O)N1CCOCC1
InChIInChI=1S/C13H18N2O2/c1-11-5-3-4-6-12(11)14(2)13(16)15-7-9-17-10-8-15/h3-6H,7-10H2,1-2H3
InChIKeyHNRHLDBSDIXIRW-UHFFFAOYSA-N
XLogP1.88
TPSA32.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.30
LogP ≤ 51.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-[methyl(1,4-oxazepane-4-carbonyl)amino]benzoic acid
CID 62968689
2-[1-[methyl-(2-methylphenyl)carbamoyl]piperidin-4-yl]acetic acid
CID 79612782
1-[methyl-(2-methylphenyl)carbamoyl]pyrrolidine-3-carboxylic acid
CID 63032105
2-[2-(N-ethyl-2-methylanilino)ethyl-methylamino]-1-morpholin-4-ylethanone
CID 71047340
N-(3-bromophenyl)-N-methylmorpholine-4-carboxamide
CID 66906368
N,6-dimethyl-N-(2-methylphenyl)-4-morpholin-4-ylfuro[2,3-d]pyrimidine-5-carboxamide
CID 20925317
N-(3-methoxyphenyl)-N-methylmorpholine-4-carboxamide
CID 116655319
N-methyl-N-(phenylcarbamoyl)morpholine-4-carboxamide
CID 12876147
N-methyl-N-(2-methylphenyl)carbamate
CID 21115000
2-[4-[2-(N-ethyl-2-methylanilino)acetyl]piperazin-1-yl]-1-morpholin-4-ylethanone
CID 78821861
4-[[methyl-(2-methylphenyl)carbamoyl]amino]oxane-4-carboxylic acid
CID 115293105
(2-hydroxy-6-methylphenyl)-morpholin-4-ylmethanone
CID 162422305

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(2-methylphenyl)morpholine-4-carboxamide?
The IUPAC name of N-methyl-N-(2-methylphenyl)morpholine-4-carboxamide (CID 116655392) is N-methyl-N-(2-methylphenyl)morpholine-4-carboxamide.
What is the SMILES notation for N-methyl-N-(2-methylphenyl)morpholine-4-carboxamide?
The canonical SMILES for N-methyl-N-(2-methylphenyl)morpholine-4-carboxamide is Cc1ccccc1N(C)C(=O)N1CCOCC1.
What is the InChIKey of N-methyl-N-(2-methylphenyl)morpholine-4-carboxamide?
The InChIKey is HNRHLDBSDIXIRW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N2O2/c1-11-5-3-4-6-12(11)14(2)13(16)15-7-9-17-10-8-15/h3-6H,7-10H2,1-2H3.
What are the key properties of N-methyl-N-(2-methylphenyl)morpholine-4-carboxamide?
N-methyl-N-(2-methylphenyl)morpholine-4-carboxamide has a molecular weight of 234.30 g/mol, XLogP of 1.88, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(2-methylphenyl)morpholine-4-carboxamide is sourced from PubChem (CID 116655392), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).