N-(3-fluoro-5-morpholin-4-ylphenyl)-4-(6-methoxy-3-pyridinyl)-2,3-dihydrofuro[2,3-c]pyridin-7-amine

C23H23FN4O3 — CID 134805718

IUPACN-(3-fluoro-5-morpholin-4-ylphenyl)-4-(6-methoxy-3-pyridinyl)-2,3-dihydrofuro[2,3-c]pyridin-7-amine
SMILESCOc1ccc(-c2cnc(Nc3cc(F)cc(N4CCOCC4)c3)c3c2CCO3)cn1
InChIInChI=1S/C23H23FN4O3/c1-29-21-3-2-15(13-25-21)20-14-26-23(22-19(20)4-7-31-22)27-17-10-16(24)11-18(12-17)28-5-8-30-9-6-28/h2-3,10-14H,4-9H2,1H3,(H,26,27)
InChIKeyZMVBVBWFPILNNO-UHFFFAOYSA-N
MW422.46 g/mol
LogP3.81
Rot. Bonds5

About N-(3-fluoro-5-morpholin-4-ylphenyl)-4-(6-methoxy-3-pyridinyl)-2,3-dihydrofuro[2,3-c]pyridin-7-amine

N-(3-fluoro-5-morpholin-4-ylphenyl)-4-(6-methoxy-3-pyridinyl)-2,3-dihydrofuro[2,3-c]pyridin-7-amine (PubChem CID 134805718) has the molecular formula C23H23FN4O3 and a molecular weight of 422.46 g/mol. Its IUPAC name is N-(3-fluoro-5-morpholin-4-ylphenyl)-4-(6-methoxy-3-pyridinyl)-2,3-dihydrofuro[2,3-c]pyridin-7-amine.

Molecular Properties

Compound NameN-(3-fluoro-5-morpholin-4-ylphenyl)-4-(6-methoxy-3-pyridinyl)-2,3-dihydrofuro[2,3-c]pyridin-7-amine
PubChem CID134805718
Molecular FormulaC23H23FN4O3
Molecular Weight422.46 g/mol
Exact Mass422.18
IUPAC NameN-(3-fluoro-5-morpholin-4-ylphenyl)-4-(6-methoxy-3-pyridinyl)-2,3-dihydrofuro[2,3-c]pyridin-7-amine
SMILESCOc1ccc(-c2cnc(Nc3cc(F)cc(N4CCOCC4)c3)c3c2CCO3)cn1
InChIInChI=1S/C23H23FN4O3/c1-29-21-3-2-15(13-25-21)20-14-26-23(22-19(20)4-7-31-22)27-17-10-16(24)11-18(12-17)28-5-8-30-9-6-28/h2-3,10-14H,4-9H2,1H3,(H,26,27)
InChIKeyZMVBVBWFPILNNO-UHFFFAOYSA-N
XLogP3.81
TPSA68.74 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500422.46
LogP ≤ 53.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of N-(3-fluoro-5-morpholin-4-ylphenyl)-4-(6-methoxy-3-pyridinyl)-2,3-dihydrofuro[2,3-c]pyridin-7-amine?
The IUPAC name of N-(3-fluoro-5-morpholin-4-ylphenyl)-4-(6-methoxy-3-pyridinyl)-2,3-dihydrofuro[2,3-c]pyridin-7-amine (CID 134805718) is N-(3-fluoro-5-morpholin-4-ylphenyl)-4-(6-methoxy-3-pyridinyl)-2,3-dihydrofuro[2,3-c]pyridin-7-amine.
What is the SMILES notation for N-(3-fluoro-5-morpholin-4-ylphenyl)-4-(6-methoxy-3-pyridinyl)-2,3-dihydrofuro[2,3-c]pyridin-7-amine?
The canonical SMILES for N-(3-fluoro-5-morpholin-4-ylphenyl)-4-(6-methoxy-3-pyridinyl)-2,3-dihydrofuro[2,3-c]pyridin-7-amine is COc1ccc(-c2cnc(Nc3cc(F)cc(N4CCOCC4)c3)c3c2CCO3)cn1.
What is the InChIKey of N-(3-fluoro-5-morpholin-4-ylphenyl)-4-(6-methoxy-3-pyridinyl)-2,3-dihydrofuro[2,3-c]pyridin-7-amine?
The InChIKey is ZMVBVBWFPILNNO-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H23FN4O3/c1-29-21-3-2-15(13-25-21)20-14-26-23(22-19(20)4-7-31-22)27-17-10-16(24)11-18(12-17)28-5-8-30-9-6-28/h2-3,10-14H,4-9H2,1H3,(H,26,27).
What are the key properties of N-(3-fluoro-5-morpholin-4-ylphenyl)-4-(6-methoxy-3-pyridinyl)-2,3-dihydrofuro[2,3-c]pyridin-7-amine?
N-(3-fluoro-5-morpholin-4-ylphenyl)-4-(6-methoxy-3-pyridinyl)-2,3-dihydrofuro[2,3-c]pyridin-7-amine has a molecular weight of 422.46 g/mol, XLogP of 3.81, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-fluoro-5-morpholin-4-ylphenyl)-4-(6-methoxy-3-pyridinyl)-2,3-dihydrofuro[2,3-c]pyridin-7-amine is sourced from PubChem (CID 134805718), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).