N-(2-ethoxy-4-methylphenyl)-2-methylmorpholine-4-carboxamide

C15H22N2O3 — CID 47262001

IUPACN-(2-ethoxy-4-methylphenyl)-2-methylmorpholine-4-carboxamide
SMILESCCOc1cc(C)ccc1NC(=O)N1CCOC(C)C1
InChIInChI=1S/C15H22N2O3/c1-4-19-14-9-11(2)5-6-13(14)16-15(18)17-7-8-20-12(3)10-17/h5-6,9,12H,4,7-8,10H2,1-3H3,(H,16,18)
InChIKeyIALLNVHGUYVZKZ-UHFFFAOYSA-N
MW278.35 g/mol
LogP2.65
Rot. Bonds3

About N-(2-ethoxy-4-methylphenyl)-2-methylmorpholine-4-carboxamide

N-(2-ethoxy-4-methylphenyl)-2-methylmorpholine-4-carboxamide (PubChem CID 47262001) has the molecular formula C15H22N2O3 and a molecular weight of 278.35 g/mol. Its IUPAC name is N-(2-ethoxy-4-methylphenyl)-2-methylmorpholine-4-carboxamide.

Molecular Properties

Compound NameN-(2-ethoxy-4-methylphenyl)-2-methylmorpholine-4-carboxamide
PubChem CID47262001
Molecular FormulaC15H22N2O3
Molecular Weight278.35 g/mol
Exact Mass278.16
IUPAC NameN-(2-ethoxy-4-methylphenyl)-2-methylmorpholine-4-carboxamide
SMILESCCOc1cc(C)ccc1NC(=O)N1CCOC(C)C1
InChIInChI=1S/C15H22N2O3/c1-4-19-14-9-11(2)5-6-13(14)16-15(18)17-7-8-20-12(3)10-17/h5-6,9,12H,4,7-8,10H2,1-3H3,(H,16,18)
InChIKeyIALLNVHGUYVZKZ-UHFFFAOYSA-N
XLogP2.65
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.35
LogP ≤ 52.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(2S)-N-(2-ethoxy-4-fluorophenyl)-2-methylmorpholine-4-carboxamide
CID 94148395
(2R)-2-(1,3-dioxolan-2-yl)-N-(2-ethoxy-4-methylphenyl)piperidine-1-carboxamide
CID 95319052
3-methyl-N-(4-methyl-2-phenylmethoxyphenyl)pyrrolidine-1-carboxamide
CID 86877135
(2S)-N-(5-acetamido-2-methylphenyl)-2-methylmorpholine-4-carboxamide
CID 94176614
N-(4-methyl-2-propoxyphenyl)-1,4-dioxa-8-azaspiro[4.5]decane-8-carboxamide
CID 51085636
N-[2-(2-methoxyethoxy)-4-methylphenyl]pyrrolidine-1-carboxamide
CID 47262655
(3S)-N-(2-ethoxy-4-fluorophenyl)-3-hydroxypyrrolidine-1-carboxamide
CID 111431407
(3R)-3-hydroxy-N-(2-methoxy-4-methylphenyl)pyrrolidine-1-carboxamide
CID 111431556
(2R)-N-(3-acetamido-4-methylphenyl)-2-methylmorpholine-4-carboxamide
CID 94183755
2-[(2-ethoxy-4-methylphenyl)carbamoyl]cyclopentane-1-carboxylic acid
CID 103978084
(3S,4S)-1-[(4-methyl-2-propoxyphenyl)carbamoyl]-4-(trifluoromethyl)pyrrolidine-3-carboxylic acid
CID 122076847
N-(2-ethoxyphenyl)-2-(2-methylmorpholin-4-yl)propanamide
CID 46677597

Frequently Asked Questions

What is the IUPAC name of N-(2-ethoxy-4-methylphenyl)-2-methylmorpholine-4-carboxamide?
The IUPAC name of N-(2-ethoxy-4-methylphenyl)-2-methylmorpholine-4-carboxamide (CID 47262001) is N-(2-ethoxy-4-methylphenyl)-2-methylmorpholine-4-carboxamide.
What is the SMILES notation for N-(2-ethoxy-4-methylphenyl)-2-methylmorpholine-4-carboxamide?
The canonical SMILES for N-(2-ethoxy-4-methylphenyl)-2-methylmorpholine-4-carboxamide is CCOc1cc(C)ccc1NC(=O)N1CCOC(C)C1.
What is the InChIKey of N-(2-ethoxy-4-methylphenyl)-2-methylmorpholine-4-carboxamide?
The InChIKey is IALLNVHGUYVZKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O3/c1-4-19-14-9-11(2)5-6-13(14)16-15(18)17-7-8-20-12(3)10-17/h5-6,9,12H,4,7-8,10H2,1-3H3,(H,16,18).
What are the key properties of N-(2-ethoxy-4-methylphenyl)-2-methylmorpholine-4-carboxamide?
N-(2-ethoxy-4-methylphenyl)-2-methylmorpholine-4-carboxamide has a molecular weight of 278.35 g/mol, XLogP of 2.65, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethoxy-4-methylphenyl)-2-methylmorpholine-4-carboxamide is sourced from PubChem (CID 47262001), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).