N-(2,4-difluoro-6-morpholin-4-ylphenyl)-6-(morpholin-4-ylmethyl)pyridin-2-amine

C20H24F2N4O2 — CID 70869751

IUPACN-(2,4-difluoro-6-morpholin-4-ylphenyl)-6-(morpholin-4-ylmethyl)pyridin-2-amine
SMILESFc1cc(F)c(Nc2cccc(CN3CCOCC3)n2)c(N2CCOCC2)c1
InChIInChI=1S/C20H24F2N4O2/c21-15-12-17(22)20(18(13-15)26-6-10-28-11-7-26)24-19-3-1-2-16(23-19)14-25-4-8-27-9-5-25/h1-3,12-13H,4-11,14H2,(H,23,24)
InChIKeyQSTLCVFZKTXVAQ-UHFFFAOYSA-N
MW390.43 g/mol
LogP2.77
Rot. Bonds5

About N-(2,4-difluoro-6-morpholin-4-ylphenyl)-6-(morpholin-4-ylmethyl)pyridin-2-amine

N-(2,4-difluoro-6-morpholin-4-ylphenyl)-6-(morpholin-4-ylmethyl)pyridin-2-amine (PubChem CID 70869751) has the molecular formula C20H24F2N4O2 and a molecular weight of 390.43 g/mol. Its IUPAC name is N-(2,4-difluoro-6-morpholin-4-ylphenyl)-6-(morpholin-4-ylmethyl)pyridin-2-amine.

Molecular Properties

Compound NameN-(2,4-difluoro-6-morpholin-4-ylphenyl)-6-(morpholin-4-ylmethyl)pyridin-2-amine
PubChem CID70869751
Molecular FormulaC20H24F2N4O2
Molecular Weight390.43 g/mol
Exact Mass390.19
IUPAC NameN-(2,4-difluoro-6-morpholin-4-ylphenyl)-6-(morpholin-4-ylmethyl)pyridin-2-amine
SMILESFc1cc(F)c(Nc2cccc(CN3CCOCC3)n2)c(N2CCOCC2)c1
InChIInChI=1S/C20H24F2N4O2/c21-15-12-17(22)20(18(13-15)26-6-10-28-11-7-26)24-19-3-1-2-16(23-19)14-25-4-8-27-9-5-25/h1-3,12-13H,4-11,14H2,(H,23,24)
InChIKeyQSTLCVFZKTXVAQ-UHFFFAOYSA-N
XLogP2.77
TPSA49.86 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms28
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500390.43
LogP ≤ 52.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-(2,4-difluoro-6-morpholin-4-ylphenyl)-6-(morpholin-4-ylmethyl)pyridin-2-amine?
The IUPAC name of N-(2,4-difluoro-6-morpholin-4-ylphenyl)-6-(morpholin-4-ylmethyl)pyridin-2-amine (CID 70869751) is N-(2,4-difluoro-6-morpholin-4-ylphenyl)-6-(morpholin-4-ylmethyl)pyridin-2-amine.
What is the SMILES notation for N-(2,4-difluoro-6-morpholin-4-ylphenyl)-6-(morpholin-4-ylmethyl)pyridin-2-amine?
The canonical SMILES for N-(2,4-difluoro-6-morpholin-4-ylphenyl)-6-(morpholin-4-ylmethyl)pyridin-2-amine is Fc1cc(F)c(Nc2cccc(CN3CCOCC3)n2)c(N2CCOCC2)c1.
What is the InChIKey of N-(2,4-difluoro-6-morpholin-4-ylphenyl)-6-(morpholin-4-ylmethyl)pyridin-2-amine?
The InChIKey is QSTLCVFZKTXVAQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24F2N4O2/c21-15-12-17(22)20(18(13-15)26-6-10-28-11-7-26)24-19-3-1-2-16(23-19)14-25-4-8-27-9-5-25/h1-3,12-13H,4-11,14H2,(H,23,24).
What are the key properties of N-(2,4-difluoro-6-morpholin-4-ylphenyl)-6-(morpholin-4-ylmethyl)pyridin-2-amine?
N-(2,4-difluoro-6-morpholin-4-ylphenyl)-6-(morpholin-4-ylmethyl)pyridin-2-amine has a molecular weight of 390.43 g/mol, XLogP of 2.77, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,4-difluoro-6-morpholin-4-ylphenyl)-6-(morpholin-4-ylmethyl)pyridin-2-amine is sourced from PubChem (CID 70869751), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).