N-(2,6-difluorophenyl)-6-(2-morpholin-4-ylethylamino)pyridine-3-carboxamide

C18H20F2N4O2 — CID 109154096

IUPACN-(2,6-difluorophenyl)-6-(2-morpholin-4-ylethylamino)pyridine-3-carboxamide
SMILESO=C(Nc1c(F)cccc1F)c1ccc(NCCN2CCOCC2)nc1
InChIInChI=1S/C18H20F2N4O2/c19-14-2-1-3-15(20)17(14)23-18(25)13-4-5-16(22-12-13)21-6-7-24-8-10-26-11-9-24/h1-5,12H,6-11H2,(H,21,22)(H,23,25)
InChIKeyVSNZTFRWIKEVCQ-UHFFFAOYSA-N
MW362.38 g/mol
LogP2.36
Rot. Bonds6

About N-(2,6-difluorophenyl)-6-(2-morpholin-4-ylethylamino)pyridine-3-carboxamide

N-(2,6-difluorophenyl)-6-(2-morpholin-4-ylethylamino)pyridine-3-carboxamide (PubChem CID 109154096) has the molecular formula C18H20F2N4O2 and a molecular weight of 362.38 g/mol. Its IUPAC name is N-(2,6-difluorophenyl)-6-(2-morpholin-4-ylethylamino)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(2,6-difluorophenyl)-6-(2-morpholin-4-ylethylamino)pyridine-3-carboxamide
PubChem CID109154096
Molecular FormulaC18H20F2N4O2
Molecular Weight362.38 g/mol
Exact Mass362.16
IUPAC NameN-(2,6-difluorophenyl)-6-(2-morpholin-4-ylethylamino)pyridine-3-carboxamide
SMILESO=C(Nc1c(F)cccc1F)c1ccc(NCCN2CCOCC2)nc1
InChIInChI=1S/C18H20F2N4O2/c19-14-2-1-3-15(20)17(14)23-18(25)13-4-5-16(22-12-13)21-6-7-24-8-10-26-11-9-24/h1-5,12H,6-11H2,(H,21,22)(H,23,25)
InChIKeyVSNZTFRWIKEVCQ-UHFFFAOYSA-N
XLogP2.36
TPSA66.49 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms26
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.38
LogP ≤ 52.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(2,6-difluorophenyl)-6-(2-morpholin-4-ylethylamino)pyridine-3-carboxamide?
The IUPAC name of N-(2,6-difluorophenyl)-6-(2-morpholin-4-ylethylamino)pyridine-3-carboxamide (CID 109154096) is N-(2,6-difluorophenyl)-6-(2-morpholin-4-ylethylamino)pyridine-3-carboxamide.
What is the SMILES notation for N-(2,6-difluorophenyl)-6-(2-morpholin-4-ylethylamino)pyridine-3-carboxamide?
The canonical SMILES for N-(2,6-difluorophenyl)-6-(2-morpholin-4-ylethylamino)pyridine-3-carboxamide is O=C(Nc1c(F)cccc1F)c1ccc(NCCN2CCOCC2)nc1.
What is the InChIKey of N-(2,6-difluorophenyl)-6-(2-morpholin-4-ylethylamino)pyridine-3-carboxamide?
The InChIKey is VSNZTFRWIKEVCQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20F2N4O2/c19-14-2-1-3-15(20)17(14)23-18(25)13-4-5-16(22-12-13)21-6-7-24-8-10-26-11-9-24/h1-5,12H,6-11H2,(H,21,22)(H,23,25).
What are the key properties of N-(2,6-difluorophenyl)-6-(2-morpholin-4-ylethylamino)pyridine-3-carboxamide?
N-(2,6-difluorophenyl)-6-(2-morpholin-4-ylethylamino)pyridine-3-carboxamide has a molecular weight of 362.38 g/mol, XLogP of 2.36, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,6-difluorophenyl)-6-(2-morpholin-4-ylethylamino)pyridine-3-carboxamide is sourced from PubChem (CID 109154096), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).