4-(5-methyl-3,4,6,7-tetrahydroimidazo[4,5-c]pyridin-2-yl)-9H-fluorene-9-carboxamide

C21H20N4O — CID 67361723

IUPAC4-(5-methyl-3,4,6,7-tetrahydroimidazo[4,5-c]pyridin-2-yl)-9H-fluorene-9-carboxamide
SMILESCN1CCc2nc(-c3cccc4c3-c3ccccc3C4C(N)=O)[nH]c2C1
InChIInChI=1S/C21H20N4O/c1-25-10-9-16-17(11-25)24-21(23-16)15-8-4-7-14-18(15)12-5-2-3-6-13(12)19(14)20(22)26/h2-8,19H,9-11H2,1H3,(H2,22,26)(H,23,24)
InChIKeyUYIYGXRBMBCSNL-UHFFFAOYSA-N
MW344.42 g/mol
LogP2.66
Rot. Bonds2

About 4-(5-methyl-3,4,6,7-tetrahydroimidazo[4,5-c]pyridin-2-yl)-9H-fluorene-9-carboxamide

4-(5-methyl-3,4,6,7-tetrahydroimidazo[4,5-c]pyridin-2-yl)-9H-fluorene-9-carboxamide (PubChem CID 67361723) has the molecular formula C21H20N4O and a molecular weight of 344.42 g/mol. Its IUPAC name is 4-(5-methyl-3,4,6,7-tetrahydroimidazo[4,5-c]pyridin-2-yl)-9H-fluorene-9-carboxamide.

Molecular Properties

Compound Name4-(5-methyl-3,4,6,7-tetrahydroimidazo[4,5-c]pyridin-2-yl)-9H-fluorene-9-carboxamide
PubChem CID67361723
Molecular FormulaC21H20N4O
Molecular Weight344.42 g/mol
Exact Mass344.16
IUPAC Name4-(5-methyl-3,4,6,7-tetrahydroimidazo[4,5-c]pyridin-2-yl)-9H-fluorene-9-carboxamide
SMILESCN1CCc2nc(-c3cccc4c3-c3ccccc3C4C(N)=O)[nH]c2C1
InChIInChI=1S/C21H20N4O/c1-25-10-9-16-17(11-25)24-21(23-16)15-8-4-7-14-18(15)12-5-2-3-6-13(12)19(14)20(22)26/h2-8,19H,9-11H2,1H3,(H2,22,26)(H,23,24)
InChIKeyUYIYGXRBMBCSNL-UHFFFAOYSA-N
XLogP2.66
TPSA75.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms26
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.42
LogP ≤ 52.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-(5-methyl-3,4,6,7-tetrahydroimidazo[4,5-c]pyridin-2-yl)-9H-fluorene-9-carboxamide?
The IUPAC name of 4-(5-methyl-3,4,6,7-tetrahydroimidazo[4,5-c]pyridin-2-yl)-9H-fluorene-9-carboxamide (CID 67361723) is 4-(5-methyl-3,4,6,7-tetrahydroimidazo[4,5-c]pyridin-2-yl)-9H-fluorene-9-carboxamide.
What is the SMILES notation for 4-(5-methyl-3,4,6,7-tetrahydroimidazo[4,5-c]pyridin-2-yl)-9H-fluorene-9-carboxamide?
The canonical SMILES for 4-(5-methyl-3,4,6,7-tetrahydroimidazo[4,5-c]pyridin-2-yl)-9H-fluorene-9-carboxamide is CN1CCc2nc(-c3cccc4c3-c3ccccc3C4C(N)=O)[nH]c2C1.
What is the InChIKey of 4-(5-methyl-3,4,6,7-tetrahydroimidazo[4,5-c]pyridin-2-yl)-9H-fluorene-9-carboxamide?
The InChIKey is UYIYGXRBMBCSNL-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H20N4O/c1-25-10-9-16-17(11-25)24-21(23-16)15-8-4-7-14-18(15)12-5-2-3-6-13(12)19(14)20(22)26/h2-8,19H,9-11H2,1H3,(H2,22,26)(H,23,24).
What are the key properties of 4-(5-methyl-3,4,6,7-tetrahydroimidazo[4,5-c]pyridin-2-yl)-9H-fluorene-9-carboxamide?
4-(5-methyl-3,4,6,7-tetrahydroimidazo[4,5-c]pyridin-2-yl)-9H-fluorene-9-carboxamide has a molecular weight of 344.42 g/mol, XLogP of 2.66, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(5-methyl-3,4,6,7-tetrahydroimidazo[4,5-c]pyridin-2-yl)-9H-fluorene-9-carboxamide is sourced from PubChem (CID 67361723), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).