2-ethoxy-N-[(4-ethoxy-3-methoxyphenyl)methyl]-N-methylpyridine-3-carboxamide

C19H24N2O4 — CID 2465649

IUPAC2-ethoxy-N-[(4-ethoxy-3-methoxyphenyl)methyl]-N-methylpyridine-3-carboxamide
SMILESCCOc1ccc(CN(C)C(=O)c2cccnc2OCC)cc1OC
InChIInChI=1S/C19H24N2O4/c1-5-24-16-10-9-14(12-17(16)23-4)13-21(3)19(22)15-8-7-11-20-18(15)25-6-2/h7-12H,5-6,13H2,1-4H3
InChIKeyQFDUMMBNEBHPSG-UHFFFAOYSA-N
MW344.41 g/mol
LogP3.16
Rot. Bonds8

About 2-ethoxy-N-[(4-ethoxy-3-methoxyphenyl)methyl]-N-methylpyridine-3-carboxamide

2-ethoxy-N-[(4-ethoxy-3-methoxyphenyl)methyl]-N-methylpyridine-3-carboxamide (PubChem CID 2465649) has the molecular formula C19H24N2O4 and a molecular weight of 344.41 g/mol. Its IUPAC name is 2-ethoxy-N-[(4-ethoxy-3-methoxyphenyl)methyl]-N-methylpyridine-3-carboxamide.

Molecular Properties

Compound Name2-ethoxy-N-[(4-ethoxy-3-methoxyphenyl)methyl]-N-methylpyridine-3-carboxamide
PubChem CID2465649
Molecular FormulaC19H24N2O4
Molecular Weight344.41 g/mol
Exact Mass344.17
IUPAC Name2-ethoxy-N-[(4-ethoxy-3-methoxyphenyl)methyl]-N-methylpyridine-3-carboxamide
SMILESCCOc1ccc(CN(C)C(=O)c2cccnc2OCC)cc1OC
InChIInChI=1S/C19H24N2O4/c1-5-24-16-10-9-14(12-17(16)23-4)13-21(3)19(22)15-8-7-11-20-18(15)25-6-2/h7-12H,5-6,13H2,1-4H3
InChIKeyQFDUMMBNEBHPSG-UHFFFAOYSA-N
XLogP3.16
TPSA60.89 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.41
LogP ≤ 53.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-N-[(4-ethoxy-3-methoxyphenyl)methyl]-N-methylpyridine-3-carboxamide?
The IUPAC name of 2-ethoxy-N-[(4-ethoxy-3-methoxyphenyl)methyl]-N-methylpyridine-3-carboxamide (CID 2465649) is 2-ethoxy-N-[(4-ethoxy-3-methoxyphenyl)methyl]-N-methylpyridine-3-carboxamide.
What is the SMILES notation for 2-ethoxy-N-[(4-ethoxy-3-methoxyphenyl)methyl]-N-methylpyridine-3-carboxamide?
The canonical SMILES for 2-ethoxy-N-[(4-ethoxy-3-methoxyphenyl)methyl]-N-methylpyridine-3-carboxamide is CCOc1ccc(CN(C)C(=O)c2cccnc2OCC)cc1OC.
What is the InChIKey of 2-ethoxy-N-[(4-ethoxy-3-methoxyphenyl)methyl]-N-methylpyridine-3-carboxamide?
The InChIKey is QFDUMMBNEBHPSG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O4/c1-5-24-16-10-9-14(12-17(16)23-4)13-21(3)19(22)15-8-7-11-20-18(15)25-6-2/h7-12H,5-6,13H2,1-4H3.
What are the key properties of 2-ethoxy-N-[(4-ethoxy-3-methoxyphenyl)methyl]-N-methylpyridine-3-carboxamide?
2-ethoxy-N-[(4-ethoxy-3-methoxyphenyl)methyl]-N-methylpyridine-3-carboxamide has a molecular weight of 344.41 g/mol, XLogP of 3.16, 8 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-N-[(4-ethoxy-3-methoxyphenyl)methyl]-N-methylpyridine-3-carboxamide is sourced from PubChem (CID 2465649), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).