1,4-di(propan-2-yl)-6H-cyclopenta[c]pyridine

C14H19N — CID 20621283

IUPAC1,4-di(propan-2-yl)-6H-cyclopenta[c]pyridine
SMILESCC(C)c1cnc(C(C)C)c2c1=CCC=2
InChIInChI=1S/C14H19N/c1-9(2)13-8-15-14(10(3)4)12-7-5-6-11(12)13/h6-10H,5H2,1-4H3
InChIKeyKFUFSDKQZCMJKZ-UHFFFAOYSA-N
MW201.31 g/mol
LogP2.29
Rot. Bonds2

About 1,4-di(propan-2-yl)-6H-cyclopenta[c]pyridine

1,4-di(propan-2-yl)-6H-cyclopenta[c]pyridine (PubChem CID 20621283) has the molecular formula C14H19N and a molecular weight of 201.31 g/mol. Its IUPAC name is 1,4-di(propan-2-yl)-6H-cyclopenta[c]pyridine.

Molecular Properties

Compound Name1,4-di(propan-2-yl)-6H-cyclopenta[c]pyridine
PubChem CID20621283
Molecular FormulaC14H19N
Molecular Weight201.31 g/mol
Exact Mass201.15
IUPAC Name1,4-di(propan-2-yl)-6H-cyclopenta[c]pyridine
SMILESCC(C)c1cnc(C(C)C)c2c1=CCC=2
InChIInChI=1S/C14H19N/c1-9(2)13-8-15-14(10(3)4)12-7-5-6-11(12)13/h6-10H,5H2,1-4H3
InChIKeyKFUFSDKQZCMJKZ-UHFFFAOYSA-N
XLogP2.29
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.31
LogP ≤ 52.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1,4-di(propan-2-yl)-6H-cyclopenta[c]pyridine?
The IUPAC name of 1,4-di(propan-2-yl)-6H-cyclopenta[c]pyridine (CID 20621283) is 1,4-di(propan-2-yl)-6H-cyclopenta[c]pyridine.
What is the SMILES notation for 1,4-di(propan-2-yl)-6H-cyclopenta[c]pyridine?
The canonical SMILES for 1,4-di(propan-2-yl)-6H-cyclopenta[c]pyridine is CC(C)c1cnc(C(C)C)c2c1=CCC=2.
What is the InChIKey of 1,4-di(propan-2-yl)-6H-cyclopenta[c]pyridine?
The InChIKey is KFUFSDKQZCMJKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N/c1-9(2)13-8-15-14(10(3)4)12-7-5-6-11(12)13/h6-10H,5H2,1-4H3.
What are the key properties of 1,4-di(propan-2-yl)-6H-cyclopenta[c]pyridine?
1,4-di(propan-2-yl)-6H-cyclopenta[c]pyridine has a molecular weight of 201.31 g/mol, XLogP of 2.29, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1,4-di(propan-2-yl)-6H-cyclopenta[c]pyridine is sourced from PubChem (CID 20621283), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).