2-ethoxy-N-[3-fluoro-4-[(2S)-morpholin-2-yl]phenyl]pyridine-4-carboxamide

C18H20FN3O3 — CID 71086823

IUPAC2-ethoxy-N-[3-fluoro-4-[(2S)-morpholin-2-yl]phenyl]pyridine-4-carboxamide
SMILESCCOc1cc(C(=O)Nc2ccc([C@H]3CNCCO3)c(F)c2)ccn1
InChIInChI=1S/C18H20FN3O3/c1-2-24-17-9-12(5-6-21-17)18(23)22-13-3-4-14(15(19)10-13)16-11-20-7-8-25-16/h3-6,9-10,16,20H,2,7-8,11H2,1H3,(H,22,23)/t16-/m1/s1
InChIKeyAOTQIDPOBHBGSP-MRXNPFEDSA-N
MW345.37 g/mol
LogP2.53
Rot. Bonds5

About 2-ethoxy-N-[3-fluoro-4-[(2S)-morpholin-2-yl]phenyl]pyridine-4-carboxamide

2-ethoxy-N-[3-fluoro-4-[(2S)-morpholin-2-yl]phenyl]pyridine-4-carboxamide (PubChem CID 71086823) has the molecular formula C18H20FN3O3 and a molecular weight of 345.37 g/mol. Its IUPAC name is 2-ethoxy-N-[3-fluoro-4-[(2S)-morpholin-2-yl]phenyl]pyridine-4-carboxamide.

Molecular Properties

Compound Name2-ethoxy-N-[3-fluoro-4-[(2S)-morpholin-2-yl]phenyl]pyridine-4-carboxamide
PubChem CID71086823
Molecular FormulaC18H20FN3O3
Molecular Weight345.37 g/mol
Exact Mass345.15
IUPAC Name2-ethoxy-N-[3-fluoro-4-[(2S)-morpholin-2-yl]phenyl]pyridine-4-carboxamide
SMILESCCOc1cc(C(=O)Nc2ccc([C@H]3CNCCO3)c(F)c2)ccn1
InChIInChI=1S/C18H20FN3O3/c1-2-24-17-9-12(5-6-21-17)18(23)22-13-3-4-14(15(19)10-13)16-11-20-7-8-25-16/h3-6,9-10,16,20H,2,7-8,11H2,1H3,(H,22,23)/t16-/m1/s1
InChIKeyAOTQIDPOBHBGSP-MRXNPFEDSA-N
XLogP2.53
TPSA72.48 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.37
LogP ≤ 52.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 2-ethoxy-N-[3-fluoro-4-[(2S)-morpholin-2-yl]phenyl]pyridine-4-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-N-[3-fluoro-4-[(2S)-morpholin-2-yl]phenyl]pyridine-4-carboxamide?
The IUPAC name of 2-ethoxy-N-[3-fluoro-4-[(2S)-morpholin-2-yl]phenyl]pyridine-4-carboxamide (CID 71086823) is 2-ethoxy-N-[3-fluoro-4-[(2S)-morpholin-2-yl]phenyl]pyridine-4-carboxamide.
What is the SMILES notation for 2-ethoxy-N-[3-fluoro-4-[(2S)-morpholin-2-yl]phenyl]pyridine-4-carboxamide?
The canonical SMILES for 2-ethoxy-N-[3-fluoro-4-[(2S)-morpholin-2-yl]phenyl]pyridine-4-carboxamide is CCOc1cc(C(=O)Nc2ccc([C@H]3CNCCO3)c(F)c2)ccn1.
What is the InChIKey of 2-ethoxy-N-[3-fluoro-4-[(2S)-morpholin-2-yl]phenyl]pyridine-4-carboxamide?
The InChIKey is AOTQIDPOBHBGSP-MRXNPFEDSA-N. The full InChI is InChI=1S/C18H20FN3O3/c1-2-24-17-9-12(5-6-21-17)18(23)22-13-3-4-14(15(19)10-13)16-11-20-7-8-25-16/h3-6,9-10,16,20H,2,7-8,11H2,1H3,(H,22,23)/t16-/m1/s1.
What are the key properties of 2-ethoxy-N-[3-fluoro-4-[(2S)-morpholin-2-yl]phenyl]pyridine-4-carboxamide?
2-ethoxy-N-[3-fluoro-4-[(2S)-morpholin-2-yl]phenyl]pyridine-4-carboxamide has a molecular weight of 345.37 g/mol, XLogP of 2.53, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-N-[3-fluoro-4-[(2S)-morpholin-2-yl]phenyl]pyridine-4-carboxamide is sourced from PubChem (CID 71086823), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).