3-methoxy-N-(3-methyl-2-pyridinyl)-4-(2-morpholin-4-yl-2-oxoethoxy)benzamide

C20H23N3O5 — CID 25161972

IUPAC3-methoxy-N-(3-methyl-2-pyridinyl)-4-(2-morpholin-4-yl-2-oxoethoxy)benzamide
SMILESCOc1cc(C(=O)Nc2ncccc2C)ccc1OCC(=O)N1CCOCC1
InChIInChI=1S/C20H23N3O5/c1-14-4-3-7-21-19(14)22-20(25)15-5-6-16(17(12-15)26-2)28-13-18(24)23-8-10-27-11-9-23/h3-7,12H,8-11,13H2,1-2H3,(H,21,22,25)
InChIKeyJQAAYFTXAACPEL-UHFFFAOYSA-N
MW385.42 g/mol
LogP1.89
Rot. Bonds6

About 3-methoxy-N-(3-methyl-2-pyridinyl)-4-(2-morpholin-4-yl-2-oxoethoxy)benzamide

3-methoxy-N-(3-methyl-2-pyridinyl)-4-(2-morpholin-4-yl-2-oxoethoxy)benzamide (PubChem CID 25161972) has the molecular formula C20H23N3O5 and a molecular weight of 385.42 g/mol. Its IUPAC name is 3-methoxy-N-(3-methyl-2-pyridinyl)-4-(2-morpholin-4-yl-2-oxoethoxy)benzamide.

Molecular Properties

Compound Name3-methoxy-N-(3-methyl-2-pyridinyl)-4-(2-morpholin-4-yl-2-oxoethoxy)benzamide
PubChem CID25161972
Molecular FormulaC20H23N3O5
Molecular Weight385.42 g/mol
Exact Mass385.16
IUPAC Name3-methoxy-N-(3-methyl-2-pyridinyl)-4-(2-morpholin-4-yl-2-oxoethoxy)benzamide
SMILESCOc1cc(C(=O)Nc2ncccc2C)ccc1OCC(=O)N1CCOCC1
InChIInChI=1S/C20H23N3O5/c1-14-4-3-7-21-19(14)22-20(25)15-5-6-16(17(12-15)26-2)28-13-18(24)23-8-10-27-11-9-23/h3-7,12H,8-11,13H2,1-2H3,(H,21,22,25)
InChIKeyJQAAYFTXAACPEL-UHFFFAOYSA-N
XLogP1.89
TPSA89.99 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500385.42
LogP ≤ 51.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 3-methoxy-N-(3-methyl-2-pyridinyl)-4-(2-morpholin-4-yl-2-oxoethoxy)benzamide?
The IUPAC name of 3-methoxy-N-(3-methyl-2-pyridinyl)-4-(2-morpholin-4-yl-2-oxoethoxy)benzamide (CID 25161972) is 3-methoxy-N-(3-methyl-2-pyridinyl)-4-(2-morpholin-4-yl-2-oxoethoxy)benzamide.
What is the SMILES notation for 3-methoxy-N-(3-methyl-2-pyridinyl)-4-(2-morpholin-4-yl-2-oxoethoxy)benzamide?
The canonical SMILES for 3-methoxy-N-(3-methyl-2-pyridinyl)-4-(2-morpholin-4-yl-2-oxoethoxy)benzamide is COc1cc(C(=O)Nc2ncccc2C)ccc1OCC(=O)N1CCOCC1.
What is the InChIKey of 3-methoxy-N-(3-methyl-2-pyridinyl)-4-(2-morpholin-4-yl-2-oxoethoxy)benzamide?
The InChIKey is JQAAYFTXAACPEL-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23N3O5/c1-14-4-3-7-21-19(14)22-20(25)15-5-6-16(17(12-15)26-2)28-13-18(24)23-8-10-27-11-9-23/h3-7,12H,8-11,13H2,1-2H3,(H,21,22,25).
What are the key properties of 3-methoxy-N-(3-methyl-2-pyridinyl)-4-(2-morpholin-4-yl-2-oxoethoxy)benzamide?
3-methoxy-N-(3-methyl-2-pyridinyl)-4-(2-morpholin-4-yl-2-oxoethoxy)benzamide has a molecular weight of 385.42 g/mol, XLogP of 1.89, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-N-(3-methyl-2-pyridinyl)-4-(2-morpholin-4-yl-2-oxoethoxy)benzamide is sourced from PubChem (CID 25161972), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).