spiro[1,2-dihydrocyclopenta[b]pyridine-6,4'-piperidine]

C12H16N2 — CID 69010944

IUPACspiro[1,2-dihydrocyclopenta[b]pyridine-6,4'-piperidine]
SMILESC1=CC2=CC3(C=C2NC1)CCNCC3
InChIInChI=1S/C12H16N2/c1-2-10-8-12(3-6-13-7-4-12)9-11(10)14-5-1/h1-2,8-9,13-14H,3-7H2
InChIKeyCWYAZFRRRBUYLH-UHFFFAOYSA-N
MW188.27 g/mol
LogP1.34
Rot. Bonds

About spiro[1,2-dihydrocyclopenta[b]pyridine-6,4'-piperidine]

spiro[1,2-dihydrocyclopenta[b]pyridine-6,4'-piperidine] (PubChem CID 69010944) has the molecular formula C12H16N2 and a molecular weight of 188.27 g/mol. Its IUPAC name is spiro[1,2-dihydrocyclopenta[b]pyridine-6,4'-piperidine].

Molecular Properties

Compound Namespiro[1,2-dihydrocyclopenta[b]pyridine-6,4'-piperidine]
PubChem CID69010944
Molecular FormulaC12H16N2
Molecular Weight188.27 g/mol
Exact Mass188.13
IUPAC Namespiro[1,2-dihydrocyclopenta[b]pyridine-6,4'-piperidine]
SMILESC1=CC2=CC3(C=C2NC1)CCNCC3
InChIInChI=1S/C12H16N2/c1-2-10-8-12(3-6-13-7-4-12)9-11(10)14-5-1/h1-2,8-9,13-14H,3-7H2
InChIKeyCWYAZFRRRBUYLH-UHFFFAOYSA-N
XLogP1.34
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.27
LogP ≤ 51.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of spiro[1,2-dihydrocyclopenta[b]pyridine-6,4'-piperidine]?
The IUPAC name of spiro[1,2-dihydrocyclopenta[b]pyridine-6,4'-piperidine] (CID 69010944) is spiro[1,2-dihydrocyclopenta[b]pyridine-6,4'-piperidine].
What is the SMILES notation for spiro[1,2-dihydrocyclopenta[b]pyridine-6,4'-piperidine]?
The canonical SMILES for spiro[1,2-dihydrocyclopenta[b]pyridine-6,4'-piperidine] is C1=CC2=CC3(C=C2NC1)CCNCC3.
What is the InChIKey of spiro[1,2-dihydrocyclopenta[b]pyridine-6,4'-piperidine]?
The InChIKey is CWYAZFRRRBUYLH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N2/c1-2-10-8-12(3-6-13-7-4-12)9-11(10)14-5-1/h1-2,8-9,13-14H,3-7H2.
What are the key properties of spiro[1,2-dihydrocyclopenta[b]pyridine-6,4'-piperidine]?
spiro[1,2-dihydrocyclopenta[b]pyridine-6,4'-piperidine] has a molecular weight of 188.27 g/mol, XLogP of 1.34, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for spiro[1,2-dihydrocyclopenta[b]pyridine-6,4'-piperidine] is sourced from PubChem (CID 69010944), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).