N-(4-ethoxy-3-methylphenyl)morpholine-4-carboxamide

C14H20N2O3 — CID 47410728

IUPACN-(4-ethoxy-3-methylphenyl)morpholine-4-carboxamide
SMILESCCOc1ccc(NC(=O)N2CCOCC2)cc1C
InChIInChI=1S/C14H20N2O3/c1-3-19-13-5-4-12(10-11(13)2)15-14(17)16-6-8-18-9-7-16/h4-5,10H,3,6-9H2,1-2H3,(H,15,17)
InChIKeyWFTKEQKGDRCTLN-UHFFFAOYSA-N
MW264.32 g/mol
LogP2.26
Rot. Bonds3

About N-(4-ethoxy-3-methylphenyl)morpholine-4-carboxamide

N-(4-ethoxy-3-methylphenyl)morpholine-4-carboxamide (PubChem CID 47410728) has the molecular formula C14H20N2O3 and a molecular weight of 264.32 g/mol. Its IUPAC name is N-(4-ethoxy-3-methylphenyl)morpholine-4-carboxamide.

Molecular Properties

Compound NameN-(4-ethoxy-3-methylphenyl)morpholine-4-carboxamide
PubChem CID47410728
Molecular FormulaC14H20N2O3
Molecular Weight264.32 g/mol
Exact Mass264.15
IUPAC NameN-(4-ethoxy-3-methylphenyl)morpholine-4-carboxamide
SMILESCCOc1ccc(NC(=O)N2CCOCC2)cc1C
InChIInChI=1S/C14H20N2O3/c1-3-19-13-5-4-12(10-11(13)2)15-14(17)16-6-8-18-9-7-16/h4-5,10H,3,6-9H2,1-2H3,(H,15,17)
InChIKeyWFTKEQKGDRCTLN-UHFFFAOYSA-N
XLogP2.26
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.32
LogP ≤ 52.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(4-ethoxy-3-methylphenyl)morpholine-4-carboxamide?
The IUPAC name of N-(4-ethoxy-3-methylphenyl)morpholine-4-carboxamide (CID 47410728) is N-(4-ethoxy-3-methylphenyl)morpholine-4-carboxamide.
What is the SMILES notation for N-(4-ethoxy-3-methylphenyl)morpholine-4-carboxamide?
The canonical SMILES for N-(4-ethoxy-3-methylphenyl)morpholine-4-carboxamide is CCOc1ccc(NC(=O)N2CCOCC2)cc1C.
What is the InChIKey of N-(4-ethoxy-3-methylphenyl)morpholine-4-carboxamide?
The InChIKey is WFTKEQKGDRCTLN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O3/c1-3-19-13-5-4-12(10-11(13)2)15-14(17)16-6-8-18-9-7-16/h4-5,10H,3,6-9H2,1-2H3,(H,15,17).
What are the key properties of N-(4-ethoxy-3-methylphenyl)morpholine-4-carboxamide?
N-(4-ethoxy-3-methylphenyl)morpholine-4-carboxamide has a molecular weight of 264.32 g/mol, XLogP of 2.26, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-ethoxy-3-methylphenyl)morpholine-4-carboxamide is sourced from PubChem (CID 47410728), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).