2-cyclohexyloxy-6-(5-methyl-3-piperidin-4-yltriazol-4-yl)pyridine

C19H27N5O — CID 166634381

IUPAC2-cyclohexyloxy-6-(5-methyl-3-piperidin-4-yltriazol-4-yl)pyridine
SMILESCc1nnn(C2CCNCC2)c1-c1cccc(OC2CCCCC2)n1
InChIInChI=1S/C19H27N5O/c1-14-19(24(23-22-14)15-10-12-20-13-11-15)17-8-5-9-18(21-17)25-16-6-3-2-4-7-16/h5,8-9,15-16,20H,2-4,6-7,10-13H2,1H3
InChIKeySRULODWBOXFYKA-UHFFFAOYSA-N
MW341.46 g/mol
LogP3.28
Rot. Bonds4

About 2-cyclohexyloxy-6-(5-methyl-3-piperidin-4-yltriazol-4-yl)pyridine

2-cyclohexyloxy-6-(5-methyl-3-piperidin-4-yltriazol-4-yl)pyridine (PubChem CID 166634381) has the molecular formula C19H27N5O and a molecular weight of 341.46 g/mol. Its IUPAC name is 2-cyclohexyloxy-6-(5-methyl-3-piperidin-4-yltriazol-4-yl)pyridine.

Molecular Properties

Compound Name2-cyclohexyloxy-6-(5-methyl-3-piperidin-4-yltriazol-4-yl)pyridine
PubChem CID166634381
Molecular FormulaC19H27N5O
Molecular Weight341.46 g/mol
Exact Mass341.22
IUPAC Name2-cyclohexyloxy-6-(5-methyl-3-piperidin-4-yltriazol-4-yl)pyridine
SMILESCc1nnn(C2CCNCC2)c1-c1cccc(OC2CCCCC2)n1
InChIInChI=1S/C19H27N5O/c1-14-19(24(23-22-14)15-10-12-20-13-11-15)17-8-5-9-18(21-17)25-16-6-3-2-4-7-16/h5,8-9,15-16,20H,2-4,6-7,10-13H2,1H3
InChIKeySRULODWBOXFYKA-UHFFFAOYSA-N
XLogP3.28
TPSA64.86 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.46
LogP ≤ 53.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-cyclohexyloxy-6-(5-methyl-3-piperidin-4-yltriazol-4-yl)pyridine?
The IUPAC name of 2-cyclohexyloxy-6-(5-methyl-3-piperidin-4-yltriazol-4-yl)pyridine (CID 166634381) is 2-cyclohexyloxy-6-(5-methyl-3-piperidin-4-yltriazol-4-yl)pyridine.
What is the SMILES notation for 2-cyclohexyloxy-6-(5-methyl-3-piperidin-4-yltriazol-4-yl)pyridine?
The canonical SMILES for 2-cyclohexyloxy-6-(5-methyl-3-piperidin-4-yltriazol-4-yl)pyridine is Cc1nnn(C2CCNCC2)c1-c1cccc(OC2CCCCC2)n1.
What is the InChIKey of 2-cyclohexyloxy-6-(5-methyl-3-piperidin-4-yltriazol-4-yl)pyridine?
The InChIKey is SRULODWBOXFYKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H27N5O/c1-14-19(24(23-22-14)15-10-12-20-13-11-15)17-8-5-9-18(21-17)25-16-6-3-2-4-7-16/h5,8-9,15-16,20H,2-4,6-7,10-13H2,1H3.
What are the key properties of 2-cyclohexyloxy-6-(5-methyl-3-piperidin-4-yltriazol-4-yl)pyridine?
2-cyclohexyloxy-6-(5-methyl-3-piperidin-4-yltriazol-4-yl)pyridine has a molecular weight of 341.46 g/mol, XLogP of 3.28, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclohexyloxy-6-(5-methyl-3-piperidin-4-yltriazol-4-yl)pyridine is sourced from PubChem (CID 166634381), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).