7-methyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)indeno[1,2-b]pyridin-5-imine

C22H27N3 — CID 580076

IUPAC7-methyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)indeno[1,2-b]pyridin-5-imine
SMILESCc1ccc2c(c1)/C(=N/C1CC(C)(C)NC(C)(C)C1)c1cccnc1-2
InChIInChI=1S/C22H27N3/c1-14-8-9-16-18(11-14)20(17-7-6-10-23-19(16)17)24-15-12-21(2,3)25-22(4,5)13-15/h6-11,15,25H,12-13H2,1-5H3/b24-20+
InChIKeyLEULJHOELBJDAC-HIXSDJFHSA-N
MW333.48 g/mol
LogP4.52
Rot. Bonds1

About 7-methyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)indeno[1,2-b]pyridin-5-imine

7-methyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)indeno[1,2-b]pyridin-5-imine (PubChem CID 580076) has the molecular formula C22H27N3 and a molecular weight of 333.48 g/mol. Its IUPAC name is 7-methyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)indeno[1,2-b]pyridin-5-imine.

Molecular Properties

Compound Name7-methyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)indeno[1,2-b]pyridin-5-imine
PubChem CID580076
Molecular FormulaC22H27N3
Molecular Weight333.48 g/mol
Exact Mass333.22
IUPAC Name7-methyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)indeno[1,2-b]pyridin-5-imine
SMILESCc1ccc2c(c1)/C(=N/C1CC(C)(C)NC(C)(C)C1)c1cccnc1-2
InChIInChI=1S/C22H27N3/c1-14-8-9-16-18(11-14)20(17-7-6-10-23-19(16)17)24-15-12-21(2,3)25-22(4,5)13-15/h6-11,15,25H,12-13H2,1-5H3/b24-20+
InChIKeyLEULJHOELBJDAC-HIXSDJFHSA-N
XLogP4.52
TPSA37.28 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.48
LogP ≤ 54.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 7-methyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)indeno[1,2-b]pyridin-5-imine?
The IUPAC name of 7-methyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)indeno[1,2-b]pyridin-5-imine (CID 580076) is 7-methyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)indeno[1,2-b]pyridin-5-imine.
What is the SMILES notation for 7-methyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)indeno[1,2-b]pyridin-5-imine?
The canonical SMILES for 7-methyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)indeno[1,2-b]pyridin-5-imine is Cc1ccc2c(c1)/C(=N/C1CC(C)(C)NC(C)(C)C1)c1cccnc1-2.
What is the InChIKey of 7-methyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)indeno[1,2-b]pyridin-5-imine?
The InChIKey is LEULJHOELBJDAC-HIXSDJFHSA-N. The full InChI is InChI=1S/C22H27N3/c1-14-8-9-16-18(11-14)20(17-7-6-10-23-19(16)17)24-15-12-21(2,3)25-22(4,5)13-15/h6-11,15,25H,12-13H2,1-5H3/b24-20+.
What are the key properties of 7-methyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)indeno[1,2-b]pyridin-5-imine?
7-methyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)indeno[1,2-b]pyridin-5-imine has a molecular weight of 333.48 g/mol, XLogP of 4.52, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)indeno[1,2-b]pyridin-5-imine is sourced from PubChem (CID 580076), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).