4-(2-methoxyphenyl)-N-(2-morpholin-4-ylethyl)oxane-4-carboxamide

C19H28N2O4 — CID 47717791

IUPAC4-(2-methoxyphenyl)-N-(2-morpholin-4-ylethyl)oxane-4-carboxamide
SMILESCOc1ccccc1C1(C(=O)NCCN2CCOCC2)CCOCC1
InChIInChI=1S/C19H28N2O4/c1-23-17-5-3-2-4-16(17)19(6-12-24-13-7-19)18(22)20-8-9-21-10-14-25-15-11-21/h2-5H,6-15H2,1H3,(H,20,22)
InChIKeyPFRDIKARBIFSNK-UHFFFAOYSA-N
MW348.44 g/mol
LogP1.19
Rot. Bonds6

About 4-(2-methoxyphenyl)-N-(2-morpholin-4-ylethyl)oxane-4-carboxamide

4-(2-methoxyphenyl)-N-(2-morpholin-4-ylethyl)oxane-4-carboxamide (PubChem CID 47717791) has the molecular formula C19H28N2O4 and a molecular weight of 348.44 g/mol. Its IUPAC name is 4-(2-methoxyphenyl)-N-(2-morpholin-4-ylethyl)oxane-4-carboxamide.

Molecular Properties

Compound Name4-(2-methoxyphenyl)-N-(2-morpholin-4-ylethyl)oxane-4-carboxamide
PubChem CID47717791
Molecular FormulaC19H28N2O4
Molecular Weight348.44 g/mol
Exact Mass348.20
IUPAC Name4-(2-methoxyphenyl)-N-(2-morpholin-4-ylethyl)oxane-4-carboxamide
SMILESCOc1ccccc1C1(C(=O)NCCN2CCOCC2)CCOCC1
InChIInChI=1S/C19H28N2O4/c1-23-17-5-3-2-4-16(17)19(6-12-24-13-7-19)18(22)20-8-9-21-10-14-25-15-11-21/h2-5H,6-15H2,1H3,(H,20,22)
InChIKeyPFRDIKARBIFSNK-UHFFFAOYSA-N
XLogP1.19
TPSA60.03 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.44
LogP ≤ 51.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-(2-fluorophenyl)-N-(2-morpholin-4-ylethyl)cyclopropane-1-carboxamide
CID 110408174
1-N-[2-(2-methoxyphenyl)ethyl]-1-N'-(2-morpholin-4-ylethyl)cyclopropane-1,1-dicarboxamide
CID 108973605
1-(3,4-dimethoxyphenyl)-N-(2-morpholin-4-ylethyl)cyclopropane-1-carboxamide
CID 110438011
2-(2-methoxyphenoxy)-N-(2-morpholin-4-ylethyl)acetamide
CID 806992
4-(2-methoxyphenyl)-N-[(4-phenylsulfanyloxan-4-yl)methyl]oxane-4-carboxamide
CID 90604708
1-[2-(2-methoxyphenyl)ethyl]-3-(2-morpholin-4-ylethyl)urea
CID 110408119
2-(2-methoxyanilino)-N-(2-morpholin-4-ylethyl)acetamide
CID 108994975
2-methoxy-6-methyl-N-(2-morpholin-4-ylethyl)benzamide
CID 131898398
N-[2-(2-chlorophenyl)-2-methoxyethyl]-4-(2-methoxyphenyl)oxane-4-carboxamide
CID 90623808
N-[3-(dimethylamino)propyl]-1-(2-methoxyphenyl)cyclopropane-1-carboxamide
CID 110437951
4-[[1-(2-methoxyphenyl)cyclopropanecarbonyl]amino]butanoic acid
CID 110466088
4-[[4-(2-methoxyphenyl)phenyl]methyl]-N-(2-piperidin-1-ylethyl)oxane-4-carboxamide
CID 129455548

Frequently Asked Questions

What is the IUPAC name of 4-(2-methoxyphenyl)-N-(2-morpholin-4-ylethyl)oxane-4-carboxamide?
The IUPAC name of 4-(2-methoxyphenyl)-N-(2-morpholin-4-ylethyl)oxane-4-carboxamide (CID 47717791) is 4-(2-methoxyphenyl)-N-(2-morpholin-4-ylethyl)oxane-4-carboxamide.
What is the SMILES notation for 4-(2-methoxyphenyl)-N-(2-morpholin-4-ylethyl)oxane-4-carboxamide?
The canonical SMILES for 4-(2-methoxyphenyl)-N-(2-morpholin-4-ylethyl)oxane-4-carboxamide is COc1ccccc1C1(C(=O)NCCN2CCOCC2)CCOCC1.
What is the InChIKey of 4-(2-methoxyphenyl)-N-(2-morpholin-4-ylethyl)oxane-4-carboxamide?
The InChIKey is PFRDIKARBIFSNK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H28N2O4/c1-23-17-5-3-2-4-16(17)19(6-12-24-13-7-19)18(22)20-8-9-21-10-14-25-15-11-21/h2-5H,6-15H2,1H3,(H,20,22).
What are the key properties of 4-(2-methoxyphenyl)-N-(2-morpholin-4-ylethyl)oxane-4-carboxamide?
4-(2-methoxyphenyl)-N-(2-morpholin-4-ylethyl)oxane-4-carboxamide has a molecular weight of 348.44 g/mol, XLogP of 1.19, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-methoxyphenyl)-N-(2-morpholin-4-ylethyl)oxane-4-carboxamide is sourced from PubChem (CID 47717791), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).