6-(cyclopropylamino)-N-(9H-fluoren-2-yl)pyridine-3-carboxamide

C22H19N3O — CID 60563532

IUPAC6-(cyclopropylamino)-N-(9H-fluoren-2-yl)pyridine-3-carboxamide
SMILESO=C(Nc1ccc2c(c1)Cc1ccccc1-2)c1ccc(NC2CC2)nc1
InChIInChI=1S/C22H19N3O/c26-22(15-5-10-21(23-13-15)24-17-6-7-17)25-18-8-9-20-16(12-18)11-14-3-1-2-4-19(14)20/h1-5,8-10,12-13,17H,6-7,11H2,(H,23,24)(H,25,26)
InChIKeyHSYIVWCUMZYIBA-UHFFFAOYSA-N
MW341.41 g/mol
LogP4.48
Rot. Bonds4

About 6-(cyclopropylamino)-N-(9H-fluoren-2-yl)pyridine-3-carboxamide

6-(cyclopropylamino)-N-(9H-fluoren-2-yl)pyridine-3-carboxamide (PubChem CID 60563532) has the molecular formula C22H19N3O and a molecular weight of 341.41 g/mol. Its IUPAC name is 6-(cyclopropylamino)-N-(9H-fluoren-2-yl)pyridine-3-carboxamide.

Molecular Properties

Compound Name6-(cyclopropylamino)-N-(9H-fluoren-2-yl)pyridine-3-carboxamide
PubChem CID60563532
Molecular FormulaC22H19N3O
Molecular Weight341.41 g/mol
Exact Mass341.15
IUPAC Name6-(cyclopropylamino)-N-(9H-fluoren-2-yl)pyridine-3-carboxamide
SMILESO=C(Nc1ccc2c(c1)Cc1ccccc1-2)c1ccc(NC2CC2)nc1
InChIInChI=1S/C22H19N3O/c26-22(15-5-10-21(23-13-15)24-17-6-7-17)25-18-8-9-20-16(12-18)11-14-3-1-2-4-19(14)20/h1-5,8-10,12-13,17H,6-7,11H2,(H,23,24)(H,25,26)
InChIKeyHSYIVWCUMZYIBA-UHFFFAOYSA-N
XLogP4.48
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms26
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.41
LogP ≤ 54.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-(cyclopropylamino)-N-(9H-fluoren-2-yl)pyridine-3-carboxamide?
The IUPAC name of 6-(cyclopropylamino)-N-(9H-fluoren-2-yl)pyridine-3-carboxamide (CID 60563532) is 6-(cyclopropylamino)-N-(9H-fluoren-2-yl)pyridine-3-carboxamide.
What is the SMILES notation for 6-(cyclopropylamino)-N-(9H-fluoren-2-yl)pyridine-3-carboxamide?
The canonical SMILES for 6-(cyclopropylamino)-N-(9H-fluoren-2-yl)pyridine-3-carboxamide is O=C(Nc1ccc2c(c1)Cc1ccccc1-2)c1ccc(NC2CC2)nc1.
What is the InChIKey of 6-(cyclopropylamino)-N-(9H-fluoren-2-yl)pyridine-3-carboxamide?
The InChIKey is HSYIVWCUMZYIBA-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H19N3O/c26-22(15-5-10-21(23-13-15)24-17-6-7-17)25-18-8-9-20-16(12-18)11-14-3-1-2-4-19(14)20/h1-5,8-10,12-13,17H,6-7,11H2,(H,23,24)(H,25,26).
What are the key properties of 6-(cyclopropylamino)-N-(9H-fluoren-2-yl)pyridine-3-carboxamide?
6-(cyclopropylamino)-N-(9H-fluoren-2-yl)pyridine-3-carboxamide has a molecular weight of 341.41 g/mol, XLogP of 4.48, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(cyclopropylamino)-N-(9H-fluoren-2-yl)pyridine-3-carboxamide is sourced from PubChem (CID 60563532), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).