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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Related Compounds

2-tert-butyl-2,3-dihydro-1H-indene;methane
CID 159665212
6,7-dihydro-5H-cyclopenta[c]pyridine-6-carboxylic acid
CID 58852290
7,8-ditert-butyl-5,6,7,8-tetrahydroisoquinoline
CID 139483291
2-tert-butyl-5-propan-2-yl-2,3-dihydro-1H-indene
CID 140575899
7-methyl-6,7,8,9-tetrahydro-5H-cyclohepta[c]pyridine
CID 142220956
2,3-dimethylbutane;6-methyl-5,6,7,8-tetrahydroisoquinoline;sulfane
CID 142276554
2-(2-methylbutan-2-yl)-1,3-dihydropyrrolo[3,4-c]pyridine
CID 123786311
7-(2-methylpropyl)-5,6,7,8-tetrahydroisoquinoline
CID 169193360
2,3-di(propan-2-yl)-3,4-dihydro-1H-2,6-naphthyridine
CID 165372704
4-(4-tert-butylpiperidin-1-yl)pyridine-3-carboxylic acid
CID 81244268
5,6-dimethyl-6,7-dihydro-5H-cyclopenta[c]pyridine;ethane
CID 143036463
6-methyl-6,7-dihydro-5H-cyclopenta[c]pyridine-5-thiol
CID 139478243

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).