2,3-dihydro-1H-cyclohepta[b]pyridine

C10H11N — CID 87114065

IUPAC2,3-dihydro-1H-cyclohepta[b]pyridine
SMILESC1=CC=C2NCCC=C2C=C1
InChIInChI=1S/C10H11N/c1-2-5-9-6-4-8-11-10(9)7-3-1/h1-3,5-7,11H,4,8H2
InChIKeyYRBPIJPNXGEUFE-UHFFFAOYSA-N
MW145.20 g/mol
LogP1.92
Rot. Bonds

About 2,3-dihydro-1H-cyclohepta[b]pyridine

2,3-dihydro-1H-cyclohepta[b]pyridine (PubChem CID 87114065) has the molecular formula C10H11N and a molecular weight of 145.20 g/mol. Its IUPAC name is 2,3-dihydro-1H-cyclohepta[b]pyridine.

Molecular Properties

Compound Name2,3-dihydro-1H-cyclohepta[b]pyridine
PubChem CID87114065
Molecular FormulaC10H11N
Molecular Weight145.20 g/mol
Exact Mass145.09
IUPAC Name2,3-dihydro-1H-cyclohepta[b]pyridine
SMILESC1=CC=C2NCCC=C2C=C1
InChIInChI=1S/C10H11N/c1-2-5-9-6-4-8-11-10(9)7-3-1/h1-3,5-7,11H,4,8H2
InChIKeyYRBPIJPNXGEUFE-UHFFFAOYSA-N
XLogP1.92
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.20
LogP ≤ 51.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2,3-dihydro-1H-cyclohepta[b]pyridine?
The IUPAC name of 2,3-dihydro-1H-cyclohepta[b]pyridine (CID 87114065) is 2,3-dihydro-1H-cyclohepta[b]pyridine.
What is the SMILES notation for 2,3-dihydro-1H-cyclohepta[b]pyridine?
The canonical SMILES for 2,3-dihydro-1H-cyclohepta[b]pyridine is C1=CC=C2NCCC=C2C=C1.
What is the InChIKey of 2,3-dihydro-1H-cyclohepta[b]pyridine?
The InChIKey is YRBPIJPNXGEUFE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11N/c1-2-5-9-6-4-8-11-10(9)7-3-1/h1-3,5-7,11H,4,8H2.
What are the key properties of 2,3-dihydro-1H-cyclohepta[b]pyridine?
2,3-dihydro-1H-cyclohepta[b]pyridine has a molecular weight of 145.20 g/mol, XLogP of 1.92, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dihydro-1H-cyclohepta[b]pyridine is sourced from PubChem (CID 87114065), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).