2,5-dimethyl-3-[(2R)-2-methylcyclohexyl]pyridine

C14H21N — CID 58667168

IUPAC2,5-dimethyl-3-[(2R)-2-methylcyclohexyl]pyridine
SMILESCc1cnc(C)c(C2CCCC[C@H]2C)c1
InChIInChI=1S/C14H21N/c1-10-8-14(12(3)15-9-10)13-7-5-4-6-11(13)2/h8-9,11,13H,4-7H2,1-3H3/t11-,13?/m1/s1
InChIKeyNYNANCNTRFVFAW-JTDNENJMSA-N
MW203.33 g/mol
LogP3.99
Rot. Bonds1

About 2,5-dimethyl-3-[(2R)-2-methylcyclohexyl]pyridine

2,5-dimethyl-3-[(2R)-2-methylcyclohexyl]pyridine (PubChem CID 58667168) has the molecular formula C14H21N and a molecular weight of 203.33 g/mol. Its IUPAC name is 2,5-dimethyl-3-[(2R)-2-methylcyclohexyl]pyridine.

Molecular Properties

Compound Name2,5-dimethyl-3-[(2R)-2-methylcyclohexyl]pyridine
PubChem CID58667168
Molecular FormulaC14H21N
Molecular Weight203.33 g/mol
Exact Mass203.17
IUPAC Name2,5-dimethyl-3-[(2R)-2-methylcyclohexyl]pyridine
SMILESCc1cnc(C)c(C2CCCC[C@H]2C)c1
InChIInChI=1S/C14H21N/c1-10-8-14(12(3)15-9-10)13-7-5-4-6-11(13)2/h8-9,11,13H,4-7H2,1-3H3/t11-,13?/m1/s1
InChIKeyNYNANCNTRFVFAW-JTDNENJMSA-N
XLogP3.99
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.33
LogP ≤ 53.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2,5-dimethyl-3-[(2R)-2-methylcyclohexyl]pyridine?
The IUPAC name of 2,5-dimethyl-3-[(2R)-2-methylcyclohexyl]pyridine (CID 58667168) is 2,5-dimethyl-3-[(2R)-2-methylcyclohexyl]pyridine.
What is the SMILES notation for 2,5-dimethyl-3-[(2R)-2-methylcyclohexyl]pyridine?
The canonical SMILES for 2,5-dimethyl-3-[(2R)-2-methylcyclohexyl]pyridine is Cc1cnc(C)c(C2CCCC[C@H]2C)c1.
What is the InChIKey of 2,5-dimethyl-3-[(2R)-2-methylcyclohexyl]pyridine?
The InChIKey is NYNANCNTRFVFAW-JTDNENJMSA-N. The full InChI is InChI=1S/C14H21N/c1-10-8-14(12(3)15-9-10)13-7-5-4-6-11(13)2/h8-9,11,13H,4-7H2,1-3H3/t11-,13?/m1/s1.
What are the key properties of 2,5-dimethyl-3-[(2R)-2-methylcyclohexyl]pyridine?
2,5-dimethyl-3-[(2R)-2-methylcyclohexyl]pyridine has a molecular weight of 203.33 g/mol, XLogP of 3.99, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-dimethyl-3-[(2R)-2-methylcyclohexyl]pyridine is sourced from PubChem (CID 58667168), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).