N-(3-fluorophenyl)-4-pyrimidin-5-yl-2,3-dihydrofuro[2,3-c]pyridin-7-amine

C17H13FN4O — CID 146674193

IUPACN-(3-fluorophenyl)-4-pyrimidin-5-yl-2,3-dihydrofuro[2,3-c]pyridin-7-amine
SMILESFc1cccc(Nc2ncc(-c3cncnc3)c3c2OCC3)c1
InChIInChI=1S/C17H13FN4O/c18-12-2-1-3-13(6-12)22-17-16-14(4-5-23-16)15(9-21-17)11-7-19-10-20-8-11/h1-3,6-10H,4-5H2,(H,21,22)
InChIKeyFMYVTWOXIKIEBY-UHFFFAOYSA-N
MW308.32 g/mol
LogP3.36
Rot. Bonds3

About N-(3-fluorophenyl)-4-pyrimidin-5-yl-2,3-dihydrofuro[2,3-c]pyridin-7-amine

N-(3-fluorophenyl)-4-pyrimidin-5-yl-2,3-dihydrofuro[2,3-c]pyridin-7-amine (PubChem CID 146674193) has the molecular formula C17H13FN4O and a molecular weight of 308.32 g/mol. Its IUPAC name is N-(3-fluorophenyl)-4-pyrimidin-5-yl-2,3-dihydrofuro[2,3-c]pyridin-7-amine.

Molecular Properties

Compound NameN-(3-fluorophenyl)-4-pyrimidin-5-yl-2,3-dihydrofuro[2,3-c]pyridin-7-amine
PubChem CID146674193
Molecular FormulaC17H13FN4O
Molecular Weight308.32 g/mol
Exact Mass308.11
IUPAC NameN-(3-fluorophenyl)-4-pyrimidin-5-yl-2,3-dihydrofuro[2,3-c]pyridin-7-amine
SMILESFc1cccc(Nc2ncc(-c3cncnc3)c3c2OCC3)c1
InChIInChI=1S/C17H13FN4O/c18-12-2-1-3-13(6-12)22-17-16-14(4-5-23-16)15(9-21-17)11-7-19-10-20-8-11/h1-3,6-10H,4-5H2,(H,21,22)
InChIKeyFMYVTWOXIKIEBY-UHFFFAOYSA-N
XLogP3.36
TPSA59.93 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.32
LogP ≤ 53.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(3-fluorophenyl)-4-pyrimidin-5-yl-2,3-dihydrofuro[2,3-c]pyridin-7-amine?
The IUPAC name of N-(3-fluorophenyl)-4-pyrimidin-5-yl-2,3-dihydrofuro[2,3-c]pyridin-7-amine (CID 146674193) is N-(3-fluorophenyl)-4-pyrimidin-5-yl-2,3-dihydrofuro[2,3-c]pyridin-7-amine.
What is the SMILES notation for N-(3-fluorophenyl)-4-pyrimidin-5-yl-2,3-dihydrofuro[2,3-c]pyridin-7-amine?
The canonical SMILES for N-(3-fluorophenyl)-4-pyrimidin-5-yl-2,3-dihydrofuro[2,3-c]pyridin-7-amine is Fc1cccc(Nc2ncc(-c3cncnc3)c3c2OCC3)c1.
What is the InChIKey of N-(3-fluorophenyl)-4-pyrimidin-5-yl-2,3-dihydrofuro[2,3-c]pyridin-7-amine?
The InChIKey is FMYVTWOXIKIEBY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H13FN4O/c18-12-2-1-3-13(6-12)22-17-16-14(4-5-23-16)15(9-21-17)11-7-19-10-20-8-11/h1-3,6-10H,4-5H2,(H,21,22).
What are the key properties of N-(3-fluorophenyl)-4-pyrimidin-5-yl-2,3-dihydrofuro[2,3-c]pyridin-7-amine?
N-(3-fluorophenyl)-4-pyrimidin-5-yl-2,3-dihydrofuro[2,3-c]pyridin-7-amine has a molecular weight of 308.32 g/mol, XLogP of 3.36, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-fluorophenyl)-4-pyrimidin-5-yl-2,3-dihydrofuro[2,3-c]pyridin-7-amine is sourced from PubChem (CID 146674193), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).