5-methyl-N-(8-tricyclo[5.2.1.02,6]decanyl)pyridin-3-amine

C16H22N2 — CID 107584885

IUPAC5-methyl-N-(8-tricyclo[5.2.1.02,6]decanyl)pyridin-3-amine
SMILESCc1cncc(NC2CC3CC2C2CCCC32)c1
InChIInChI=1S/C16H22N2/c1-10-5-12(9-17-8-10)18-16-7-11-6-15(16)14-4-2-3-13(11)14/h5,8-9,11,13-16,18H,2-4,6-7H2,1H3
InChIKeyHIIWESNDOUYKBO-UHFFFAOYSA-N
MW242.37 g/mol
LogP3.63
Rot. Bonds2

About 5-methyl-N-(8-tricyclo[5.2.1.02,6]decanyl)pyridin-3-amine

5-methyl-N-(8-tricyclo[5.2.1.02,6]decanyl)pyridin-3-amine (PubChem CID 107584885) has the molecular formula C16H22N2 and a molecular weight of 242.37 g/mol. Its IUPAC name is 5-methyl-N-(8-tricyclo[5.2.1.02,6]decanyl)pyridin-3-amine.

Molecular Properties

Compound Name5-methyl-N-(8-tricyclo[5.2.1.02,6]decanyl)pyridin-3-amine
PubChem CID107584885
Molecular FormulaC16H22N2
Molecular Weight242.37 g/mol
Exact Mass242.18
IUPAC Name5-methyl-N-(8-tricyclo[5.2.1.02,6]decanyl)pyridin-3-amine
SMILESCc1cncc(NC2CC3CC2C2CCCC32)c1
InChIInChI=1S/C16H22N2/c1-10-5-12(9-17-8-10)18-16-7-11-6-15(16)14-4-2-3-13(11)14/h5,8-9,11,13-16,18H,2-4,6-7H2,1H3
InChIKeyHIIWESNDOUYKBO-UHFFFAOYSA-N
XLogP3.63
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.37
LogP ≤ 53.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-methyl-N-(8-tricyclo[5.2.1.02,6]decanyl)pyridin-3-amine?
The IUPAC name of 5-methyl-N-(8-tricyclo[5.2.1.02,6]decanyl)pyridin-3-amine (CID 107584885) is 5-methyl-N-(8-tricyclo[5.2.1.02,6]decanyl)pyridin-3-amine.
What is the SMILES notation for 5-methyl-N-(8-tricyclo[5.2.1.02,6]decanyl)pyridin-3-amine?
The canonical SMILES for 5-methyl-N-(8-tricyclo[5.2.1.02,6]decanyl)pyridin-3-amine is Cc1cncc(NC2CC3CC2C2CCCC32)c1.
What is the InChIKey of 5-methyl-N-(8-tricyclo[5.2.1.02,6]decanyl)pyridin-3-amine?
The InChIKey is HIIWESNDOUYKBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N2/c1-10-5-12(9-17-8-10)18-16-7-11-6-15(16)14-4-2-3-13(11)14/h5,8-9,11,13-16,18H,2-4,6-7H2,1H3.
What are the key properties of 5-methyl-N-(8-tricyclo[5.2.1.02,6]decanyl)pyridin-3-amine?
5-methyl-N-(8-tricyclo[5.2.1.02,6]decanyl)pyridin-3-amine has a molecular weight of 242.37 g/mol, XLogP of 3.63, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-N-(8-tricyclo[5.2.1.02,6]decanyl)pyridin-3-amine is sourced from PubChem (CID 107584885), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).