2-(4-methoxyphenyl)-3-naphthalen-1-yl-4H-furo[2,3-d]pyrimidin-4-amine

C23H19N3O2 — CID 69209426

IUPAC2-(4-methoxyphenyl)-3-naphthalen-1-yl-4H-furo[2,3-d]pyrimidin-4-amine
SMILESCOc1ccc(C2=Nc3occc3C(N)N2c2cccc3ccccc23)cc1
InChIInChI=1S/C23H19N3O2/c1-27-17-11-9-16(10-12-17)22-25-23-19(13-14-28-23)21(24)26(22)20-8-4-6-15-5-2-3-7-18(15)20/h2-14,21H,24H2,1H3
InChIKeyUBAJEXTVOKGLRB-UHFFFAOYSA-N
MW369.42 g/mol
LogP5.00
Rot. Bonds3

About 2-(4-methoxyphenyl)-3-naphthalen-1-yl-4H-furo[2,3-d]pyrimidin-4-amine

2-(4-methoxyphenyl)-3-naphthalen-1-yl-4H-furo[2,3-d]pyrimidin-4-amine (PubChem CID 69209426) has the molecular formula C23H19N3O2 and a molecular weight of 369.42 g/mol. Its IUPAC name is 2-(4-methoxyphenyl)-3-naphthalen-1-yl-4H-furo[2,3-d]pyrimidin-4-amine.

Molecular Properties

Compound Name2-(4-methoxyphenyl)-3-naphthalen-1-yl-4H-furo[2,3-d]pyrimidin-4-amine
PubChem CID69209426
Molecular FormulaC23H19N3O2
Molecular Weight369.42 g/mol
Exact Mass369.15
IUPAC Name2-(4-methoxyphenyl)-3-naphthalen-1-yl-4H-furo[2,3-d]pyrimidin-4-amine
SMILESCOc1ccc(C2=Nc3occc3C(N)N2c2cccc3ccccc23)cc1
InChIInChI=1S/C23H19N3O2/c1-27-17-11-9-16(10-12-17)22-25-23-19(13-14-28-23)21(24)26(22)20-8-4-6-15-5-2-3-7-18(15)20/h2-14,21H,24H2,1H3
InChIKeyUBAJEXTVOKGLRB-UHFFFAOYSA-N
XLogP5.00
TPSA63.99 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.42
LogP ≤ 55.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(4-methoxyphenyl)-3-naphthalen-1-yl-4H-furo[2,3-d]pyrimidin-4-amine?
The IUPAC name of 2-(4-methoxyphenyl)-3-naphthalen-1-yl-4H-furo[2,3-d]pyrimidin-4-amine (CID 69209426) is 2-(4-methoxyphenyl)-3-naphthalen-1-yl-4H-furo[2,3-d]pyrimidin-4-amine.
What is the SMILES notation for 2-(4-methoxyphenyl)-3-naphthalen-1-yl-4H-furo[2,3-d]pyrimidin-4-amine?
The canonical SMILES for 2-(4-methoxyphenyl)-3-naphthalen-1-yl-4H-furo[2,3-d]pyrimidin-4-amine is COc1ccc(C2=Nc3occc3C(N)N2c2cccc3ccccc23)cc1.
What is the InChIKey of 2-(4-methoxyphenyl)-3-naphthalen-1-yl-4H-furo[2,3-d]pyrimidin-4-amine?
The InChIKey is UBAJEXTVOKGLRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H19N3O2/c1-27-17-11-9-16(10-12-17)22-25-23-19(13-14-28-23)21(24)26(22)20-8-4-6-15-5-2-3-7-18(15)20/h2-14,21H,24H2,1H3.
What are the key properties of 2-(4-methoxyphenyl)-3-naphthalen-1-yl-4H-furo[2,3-d]pyrimidin-4-amine?
2-(4-methoxyphenyl)-3-naphthalen-1-yl-4H-furo[2,3-d]pyrimidin-4-amine has a molecular weight of 369.42 g/mol, XLogP of 5.00, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methoxyphenyl)-3-naphthalen-1-yl-4H-furo[2,3-d]pyrimidin-4-amine is sourced from PubChem (CID 69209426), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).