2-(methoxymethyl)-N-[(2-methylphenyl)methyl]morpholine-4-carboxamide

C15H22N2O3 — CID 71868624

IUPAC2-(methoxymethyl)-N-[(2-methylphenyl)methyl]morpholine-4-carboxamide
SMILESCOCC1CN(C(=O)NCc2ccccc2C)CCO1
InChIInChI=1S/C15H22N2O3/c1-12-5-3-4-6-13(12)9-16-15(18)17-7-8-20-14(10-17)11-19-2/h3-6,14H,7-11H2,1-2H3,(H,16,18)
InChIKeyBFROSGQPJOGPDU-UHFFFAOYSA-N
MW278.35 g/mol
LogP1.55
Rot. Bonds4

About 2-(methoxymethyl)-N-[(2-methylphenyl)methyl]morpholine-4-carboxamide

2-(methoxymethyl)-N-[(2-methylphenyl)methyl]morpholine-4-carboxamide (PubChem CID 71868624) has the molecular formula C15H22N2O3 and a molecular weight of 278.35 g/mol. Its IUPAC name is 2-(methoxymethyl)-N-[(2-methylphenyl)methyl]morpholine-4-carboxamide.

Molecular Properties

Compound Name2-(methoxymethyl)-N-[(2-methylphenyl)methyl]morpholine-4-carboxamide
PubChem CID71868624
Molecular FormulaC15H22N2O3
Molecular Weight278.35 g/mol
Exact Mass278.16
IUPAC Name2-(methoxymethyl)-N-[(2-methylphenyl)methyl]morpholine-4-carboxamide
SMILESCOCC1CN(C(=O)NCc2ccccc2C)CCO1
InChIInChI=1S/C15H22N2O3/c1-12-5-3-4-6-13(12)9-16-15(18)17-7-8-20-14(10-17)11-19-2/h3-6,14H,7-11H2,1-2H3,(H,16,18)
InChIKeyBFROSGQPJOGPDU-UHFFFAOYSA-N
XLogP1.55
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.35
LogP ≤ 51.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(methoxymethyl)-N-[(2-methylphenyl)methyl]morpholine-4-carboxamide?
The IUPAC name of 2-(methoxymethyl)-N-[(2-methylphenyl)methyl]morpholine-4-carboxamide (CID 71868624) is 2-(methoxymethyl)-N-[(2-methylphenyl)methyl]morpholine-4-carboxamide.
What is the SMILES notation for 2-(methoxymethyl)-N-[(2-methylphenyl)methyl]morpholine-4-carboxamide?
The canonical SMILES for 2-(methoxymethyl)-N-[(2-methylphenyl)methyl]morpholine-4-carboxamide is COCC1CN(C(=O)NCc2ccccc2C)CCO1.
What is the InChIKey of 2-(methoxymethyl)-N-[(2-methylphenyl)methyl]morpholine-4-carboxamide?
The InChIKey is BFROSGQPJOGPDU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O3/c1-12-5-3-4-6-13(12)9-16-15(18)17-7-8-20-14(10-17)11-19-2/h3-6,14H,7-11H2,1-2H3,(H,16,18).
What are the key properties of 2-(methoxymethyl)-N-[(2-methylphenyl)methyl]morpholine-4-carboxamide?
2-(methoxymethyl)-N-[(2-methylphenyl)methyl]morpholine-4-carboxamide has a molecular weight of 278.35 g/mol, XLogP of 1.55, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(methoxymethyl)-N-[(2-methylphenyl)methyl]morpholine-4-carboxamide is sourced from PubChem (CID 71868624), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).