7-(2-methyl-4-pyridinyl)-4-(3-phenylphenyl)furo[2,3-c]pyridine-2,3-diamine

C25H20N4O — CID 118871043

IUPAC7-(2-methyl-4-pyridinyl)-4-(3-phenylphenyl)furo[2,3-c]pyridine-2,3-diamine
SMILESCc1cc(-c2ncc(-c3cccc(-c4ccccc4)c3)c3c(N)c(N)oc23)ccn1
InChIInChI=1S/C25H20N4O/c1-15-12-19(10-11-28-15)23-24-21(22(26)25(27)30-24)20(14-29-23)18-9-5-8-17(13-18)16-6-3-2-4-7-16/h2-14H,26-27H2,1H3
InChIKeyYIUWWCCCBJLPPW-UHFFFAOYSA-N
MW392.46 g/mol
LogP5.70
Rot. Bonds3

About 7-(2-methyl-4-pyridinyl)-4-(3-phenylphenyl)furo[2,3-c]pyridine-2,3-diamine

7-(2-methyl-4-pyridinyl)-4-(3-phenylphenyl)furo[2,3-c]pyridine-2,3-diamine (PubChem CID 118871043) has the molecular formula C25H20N4O and a molecular weight of 392.46 g/mol. Its IUPAC name is 7-(2-methyl-4-pyridinyl)-4-(3-phenylphenyl)furo[2,3-c]pyridine-2,3-diamine.

Molecular Properties

Compound Name7-(2-methyl-4-pyridinyl)-4-(3-phenylphenyl)furo[2,3-c]pyridine-2,3-diamine
PubChem CID118871043
Molecular FormulaC25H20N4O
Molecular Weight392.46 g/mol
Exact Mass392.16
IUPAC Name7-(2-methyl-4-pyridinyl)-4-(3-phenylphenyl)furo[2,3-c]pyridine-2,3-diamine
SMILESCc1cc(-c2ncc(-c3cccc(-c4ccccc4)c3)c3c(N)c(N)oc23)ccn1
InChIInChI=1S/C25H20N4O/c1-15-12-19(10-11-28-15)23-24-21(22(26)25(27)30-24)20(14-29-23)18-9-5-8-17(13-18)16-6-3-2-4-7-16/h2-14H,26-27H2,1H3
InChIKeyYIUWWCCCBJLPPW-UHFFFAOYSA-N
XLogP5.70
TPSA90.96 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500392.46
LogP ≤ 55.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 7-(2-methyl-4-pyridinyl)-4-(3-phenylphenyl)furo[2,3-c]pyridine-2,3-diamine?
The IUPAC name of 7-(2-methyl-4-pyridinyl)-4-(3-phenylphenyl)furo[2,3-c]pyridine-2,3-diamine (CID 118871043) is 7-(2-methyl-4-pyridinyl)-4-(3-phenylphenyl)furo[2,3-c]pyridine-2,3-diamine.
What is the SMILES notation for 7-(2-methyl-4-pyridinyl)-4-(3-phenylphenyl)furo[2,3-c]pyridine-2,3-diamine?
The canonical SMILES for 7-(2-methyl-4-pyridinyl)-4-(3-phenylphenyl)furo[2,3-c]pyridine-2,3-diamine is Cc1cc(-c2ncc(-c3cccc(-c4ccccc4)c3)c3c(N)c(N)oc23)ccn1.
What is the InChIKey of 7-(2-methyl-4-pyridinyl)-4-(3-phenylphenyl)furo[2,3-c]pyridine-2,3-diamine?
The InChIKey is YIUWWCCCBJLPPW-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H20N4O/c1-15-12-19(10-11-28-15)23-24-21(22(26)25(27)30-24)20(14-29-23)18-9-5-8-17(13-18)16-6-3-2-4-7-16/h2-14H,26-27H2,1H3.
What are the key properties of 7-(2-methyl-4-pyridinyl)-4-(3-phenylphenyl)furo[2,3-c]pyridine-2,3-diamine?
7-(2-methyl-4-pyridinyl)-4-(3-phenylphenyl)furo[2,3-c]pyridine-2,3-diamine has a molecular weight of 392.46 g/mol, XLogP of 5.70, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(2-methyl-4-pyridinyl)-4-(3-phenylphenyl)furo[2,3-c]pyridine-2,3-diamine is sourced from PubChem (CID 118871043), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).