6-tert-butyl-6,7-dihydro-5H-cyclopenta[c]pyridine

C12H17N — CID 69281677

IUPAC6-tert-butyl-6,7-dihydro-5H-cyclopenta[c]pyridine
SMILESCC(C)(C)C1Cc2ccncc2C1
InChIInChI=1S/C12H17N/c1-12(2,3)11-6-9-4-5-13-8-10(9)7-11/h4-5,8,11H,6-7H2,1-3H3
InChIKeyLHXZYOUWHWLNHS-UHFFFAOYSA-N
MW175.28 g/mol
LogP2.84
Rot. Bonds

About 6-tert-butyl-6,7-dihydro-5H-cyclopenta[c]pyridine

6-tert-butyl-6,7-dihydro-5H-cyclopenta[c]pyridine (PubChem CID 69281677) has the molecular formula C12H17N and a molecular weight of 175.28 g/mol. Its IUPAC name is 6-tert-butyl-6,7-dihydro-5H-cyclopenta[c]pyridine.

Molecular Properties

Compound Name6-tert-butyl-6,7-dihydro-5H-cyclopenta[c]pyridine
PubChem CID69281677
Molecular FormulaC12H17N
Molecular Weight175.28 g/mol
Exact Mass175.14
IUPAC Name6-tert-butyl-6,7-dihydro-5H-cyclopenta[c]pyridine
SMILESCC(C)(C)C1Cc2ccncc2C1
InChIInChI=1S/C12H17N/c1-12(2,3)11-6-9-4-5-13-8-10(9)7-11/h4-5,8,11H,6-7H2,1-3H3
InChIKeyLHXZYOUWHWLNHS-UHFFFAOYSA-N
XLogP2.84
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500175.28
LogP ≤ 52.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 6-tert-butyl-6,7-dihydro-5H-cyclopenta[c]pyridine?
The IUPAC name of 6-tert-butyl-6,7-dihydro-5H-cyclopenta[c]pyridine (CID 69281677) is 6-tert-butyl-6,7-dihydro-5H-cyclopenta[c]pyridine.
What is the SMILES notation for 6-tert-butyl-6,7-dihydro-5H-cyclopenta[c]pyridine?
The canonical SMILES for 6-tert-butyl-6,7-dihydro-5H-cyclopenta[c]pyridine is CC(C)(C)C1Cc2ccncc2C1.
What is the InChIKey of 6-tert-butyl-6,7-dihydro-5H-cyclopenta[c]pyridine?
The InChIKey is LHXZYOUWHWLNHS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17N/c1-12(2,3)11-6-9-4-5-13-8-10(9)7-11/h4-5,8,11H,6-7H2,1-3H3.
What are the key properties of 6-tert-butyl-6,7-dihydro-5H-cyclopenta[c]pyridine?
6-tert-butyl-6,7-dihydro-5H-cyclopenta[c]pyridine has a molecular weight of 175.28 g/mol, XLogP of 2.84, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-tert-butyl-6,7-dihydro-5H-cyclopenta[c]pyridine is sourced from PubChem (CID 69281677), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).