6-methyl-8,8a-dihydrophosphinino[2,3-b]pyridine

C9H10NP — CID 123360660

IUPAC6-methyl-8,8a-dihydrophosphinino[2,3-b]pyridine
SMILESCC1=CPC2N=CC=CC2=C1
InChIInChI=1S/C9H10NP/c1-7-5-8-3-2-4-10-9(8)11-6-7/h2-6,9,11H,1H3
InChIKeyAARUUPNILAHCDB-UHFFFAOYSA-N
MW163.16 g/mol
LogP2.48
Rot. Bonds

About 6-methyl-8,8a-dihydrophosphinino[2,3-b]pyridine

6-methyl-8,8a-dihydrophosphinino[2,3-b]pyridine (PubChem CID 123360660) has the molecular formula C9H10NP and a molecular weight of 163.16 g/mol. Its IUPAC name is 6-methyl-8,8a-dihydrophosphinino[2,3-b]pyridine.

Molecular Properties

Compound Name6-methyl-8,8a-dihydrophosphinino[2,3-b]pyridine
PubChem CID123360660
Molecular FormulaC9H10NP
Molecular Weight163.16 g/mol
Exact Mass163.06
IUPAC Name6-methyl-8,8a-dihydrophosphinino[2,3-b]pyridine
SMILESCC1=CPC2N=CC=CC2=C1
InChIInChI=1S/C9H10NP/c1-7-5-8-3-2-4-10-9(8)11-6-7/h2-6,9,11H,1H3
InChIKeyAARUUPNILAHCDB-UHFFFAOYSA-N
XLogP2.48
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.16
LogP ≤ 52.48
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

(3Z)-3-[(Z)-but-2-enylidene]-2H-pyridine
CID 126688033
(3Z,5Z,8Z)-3-methyl-2,7-dihydroazecine
CID 155311636
ethane;3-methylidene-2H-pyridine
CID 163579422
(3Z,8Z)-4-methyl-7-methylidene-2H-azecine
CID 173717398
3-propylidene-2H-pyridine
CID 161281629

Frequently Asked Questions

What is the IUPAC name of 6-methyl-8,8a-dihydrophosphinino[2,3-b]pyridine?
The IUPAC name of 6-methyl-8,8a-dihydrophosphinino[2,3-b]pyridine (CID 123360660) is 6-methyl-8,8a-dihydrophosphinino[2,3-b]pyridine.
What is the SMILES notation for 6-methyl-8,8a-dihydrophosphinino[2,3-b]pyridine?
The canonical SMILES for 6-methyl-8,8a-dihydrophosphinino[2,3-b]pyridine is CC1=CPC2N=CC=CC2=C1.
What is the InChIKey of 6-methyl-8,8a-dihydrophosphinino[2,3-b]pyridine?
The InChIKey is AARUUPNILAHCDB-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10NP/c1-7-5-8-3-2-4-10-9(8)11-6-7/h2-6,9,11H,1H3.
What are the key properties of 6-methyl-8,8a-dihydrophosphinino[2,3-b]pyridine?
6-methyl-8,8a-dihydrophosphinino[2,3-b]pyridine has a molecular weight of 163.16 g/mol, XLogP of 2.48, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-8,8a-dihydrophosphinino[2,3-b]pyridine is sourced from PubChem (CID 123360660), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).