6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridin-8-ylmethylphosphane

C11H16NP — CID 145086188

IUPAC6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridin-8-ylmethylphosphane
SMILESPCC1CCCc2cccnc2C1
InChIInChI=1S/C11H16NP/c13-8-9-3-1-4-10-5-2-6-12-11(10)7-9/h2,5-6,9H,1,3-4,7-8,13H2
InChIKeyXLBSCQYJAMZNMC-UHFFFAOYSA-N
MW193.23 g/mol
LogP2.45
Rot. Bonds1

About 6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridin-8-ylmethylphosphane

6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridin-8-ylmethylphosphane (PubChem CID 145086188) has the molecular formula C11H16NP and a molecular weight of 193.23 g/mol. Its IUPAC name is 6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridin-8-ylmethylphosphane.

Molecular Properties

Compound Name6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridin-8-ylmethylphosphane
PubChem CID145086188
Molecular FormulaC11H16NP
Molecular Weight193.23 g/mol
Exact Mass193.10
IUPAC Name6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridin-8-ylmethylphosphane
SMILESPCC1CCCc2cccnc2C1
InChIInChI=1S/C11H16NP/c13-8-9-3-1-4-10-5-2-6-12-11(10)7-9/h2,5-6,9H,1,3-4,7-8,13H2
InChIKeyXLBSCQYJAMZNMC-UHFFFAOYSA-N
XLogP2.45
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.23
LogP ≤ 52.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'phosphor', 'substructure': 'N/A'}

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Related Compounds

7-(2,2-dimethylpropyl)-5,6,7,8-tetrahydroquinoline
CID 138515872
5,6,7,8-tetrahydroquinolin-7-amine;hydrochloride
CID 156621052
12-azabicyclo[9.4.0]pentadeca-1(11),12,14-triene
CID 175984451
ethane;(7S)-7-methyl-5,6,7,8-tetrahydroquinoline
CID 143143665
(7R)-7-[3-(1H-pyrazol-5-yl)propyl]-5,6,7,8-tetrahydroquinoline
CID 159103628
6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridin-7-ylmethanamine
CID 123242170
7-(azetidin-1-yl)-5,6,7,8-tetrahydroquinoline
CID 14835988
azane;phosphane;6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridine
CID 175101128
(5,6,7,8-tetrahydroquinolin-7-ylamino)methanol
CID 14835920
(7S)-7-tert-butyl-5,6,7,8-tetrahydroquinoline
CID 69281697
5,6,7,8-tetrahydroquinolin-6-ylmethanol
CID 69108967
N-(cyclopentylmethyl)-5,6,7,8-tetrahydroquinolin-8-amine
CID 79079348

Frequently Asked Questions

What is the IUPAC name of 6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridin-8-ylmethylphosphane?
The IUPAC name of 6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridin-8-ylmethylphosphane (CID 145086188) is 6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridin-8-ylmethylphosphane.
What is the SMILES notation for 6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridin-8-ylmethylphosphane?
The canonical SMILES for 6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridin-8-ylmethylphosphane is PCC1CCCc2cccnc2C1.
What is the InChIKey of 6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridin-8-ylmethylphosphane?
The InChIKey is XLBSCQYJAMZNMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16NP/c13-8-9-3-1-4-10-5-2-6-12-11(10)7-9/h2,5-6,9H,1,3-4,7-8,13H2.
What are the key properties of 6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridin-8-ylmethylphosphane?
6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridin-8-ylmethylphosphane has a molecular weight of 193.23 g/mol, XLogP of 2.45, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridin-8-ylmethylphosphane is sourced from PubChem (CID 145086188), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).