N-(4,6-dimethyl-2-pyridinyl)-2-[(2-fluorophenoxy)methyl]morpholine-4-carboxamide

C19H22FN3O3 — CID 24899228

IUPACN-(4,6-dimethyl-2-pyridinyl)-2-[(2-fluorophenoxy)methyl]morpholine-4-carboxamide
SMILESCc1cc(C)nc(NC(=O)N2CCOC(COc3ccccc3F)C2)c1
InChIInChI=1S/C19H22FN3O3/c1-13-9-14(2)21-18(10-13)22-19(24)23-7-8-25-15(11-23)12-26-17-6-4-3-5-16(17)20/h3-6,9-10,15H,7-8,11-12H2,1-2H3,(H,21,22,24)
InChIKeyIUVJLEGAVGUQIP-UHFFFAOYSA-N
MW359.40 g/mol
LogP3.15
Rot. Bonds4

About N-(4,6-dimethyl-2-pyridinyl)-2-[(2-fluorophenoxy)methyl]morpholine-4-carboxamide

N-(4,6-dimethyl-2-pyridinyl)-2-[(2-fluorophenoxy)methyl]morpholine-4-carboxamide (PubChem CID 24899228) has the molecular formula C19H22FN3O3 and a molecular weight of 359.40 g/mol. Its IUPAC name is N-(4,6-dimethyl-2-pyridinyl)-2-[(2-fluorophenoxy)methyl]morpholine-4-carboxamide.

Molecular Properties

Compound NameN-(4,6-dimethyl-2-pyridinyl)-2-[(2-fluorophenoxy)methyl]morpholine-4-carboxamide
PubChem CID24899228
Molecular FormulaC19H22FN3O3
Molecular Weight359.40 g/mol
Exact Mass359.16
IUPAC NameN-(4,6-dimethyl-2-pyridinyl)-2-[(2-fluorophenoxy)methyl]morpholine-4-carboxamide
SMILESCc1cc(C)nc(NC(=O)N2CCOC(COc3ccccc3F)C2)c1
InChIInChI=1S/C19H22FN3O3/c1-13-9-14(2)21-18(10-13)22-19(24)23-7-8-25-15(11-23)12-26-17-6-4-3-5-16(17)20/h3-6,9-10,15H,7-8,11-12H2,1-2H3,(H,21,22,24)
InChIKeyIUVJLEGAVGUQIP-UHFFFAOYSA-N
XLogP3.15
TPSA63.69 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500359.40
LogP ≤ 53.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(4,6-dimethyl-2-pyridinyl)-2-[(2-fluorophenoxy)methyl]morpholine-4-carboxamide?
The IUPAC name of N-(4,6-dimethyl-2-pyridinyl)-2-[(2-fluorophenoxy)methyl]morpholine-4-carboxamide (CID 24899228) is N-(4,6-dimethyl-2-pyridinyl)-2-[(2-fluorophenoxy)methyl]morpholine-4-carboxamide.
What is the SMILES notation for N-(4,6-dimethyl-2-pyridinyl)-2-[(2-fluorophenoxy)methyl]morpholine-4-carboxamide?
The canonical SMILES for N-(4,6-dimethyl-2-pyridinyl)-2-[(2-fluorophenoxy)methyl]morpholine-4-carboxamide is Cc1cc(C)nc(NC(=O)N2CCOC(COc3ccccc3F)C2)c1.
What is the InChIKey of N-(4,6-dimethyl-2-pyridinyl)-2-[(2-fluorophenoxy)methyl]morpholine-4-carboxamide?
The InChIKey is IUVJLEGAVGUQIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22FN3O3/c1-13-9-14(2)21-18(10-13)22-19(24)23-7-8-25-15(11-23)12-26-17-6-4-3-5-16(17)20/h3-6,9-10,15H,7-8,11-12H2,1-2H3,(H,21,22,24).
What are the key properties of N-(4,6-dimethyl-2-pyridinyl)-2-[(2-fluorophenoxy)methyl]morpholine-4-carboxamide?
N-(4,6-dimethyl-2-pyridinyl)-2-[(2-fluorophenoxy)methyl]morpholine-4-carboxamide has a molecular weight of 359.40 g/mol, XLogP of 3.15, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4,6-dimethyl-2-pyridinyl)-2-[(2-fluorophenoxy)methyl]morpholine-4-carboxamide is sourced from PubChem (CID 24899228), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).