dihydroxy(oxo)phosphanium;2-methylquinoline

C10H11NO3P+ — CID 174867800

IUPACdihydroxy(oxo)phosphanium;2-methylquinoline
SMILESCc1ccc2ccccc2n1.O=[P+](O)O
InChIInChI=1S/C10H9N.HO3P/c1-8-6-7-9-4-2-3-5-10(9)11-8;1-4(2)3/h2-7H,1H3;(H-,1,2,3)/p+1
InChIKeyNEVMAFOMRZXJDP-UHFFFAOYSA-O
MW224.18 g/mol
LogP2.17
Rot. Bonds

About dihydroxy(oxo)phosphanium;2-methylquinoline

dihydroxy(oxo)phosphanium;2-methylquinoline (PubChem CID 174867800) has the molecular formula C10H11NO3P+ and a molecular weight of 224.18 g/mol. Its IUPAC name is dihydroxy(oxo)phosphanium;2-methylquinoline.

Molecular Properties

Compound Namedihydroxy(oxo)phosphanium;2-methylquinoline
PubChem CID174867800
Molecular FormulaC10H11NO3P+
Molecular Weight224.18 g/mol
Exact Mass224.05
IUPAC Namedihydroxy(oxo)phosphanium;2-methylquinoline
SMILESCc1ccc2ccccc2n1.O=[P+](O)O
InChIInChI=1S/C10H9N.HO3P/c1-8-6-7-9-4-2-3-5-10(9)11-8;1-4(2)3/h2-7H,1H3;(H-,1,2,3)/p+1
InChIKeyNEVMAFOMRZXJDP-UHFFFAOYSA-O
XLogP2.17
TPSA70.42 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.18
LogP ≤ 52.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

ethane;methane;2-methylquinoline
CID 144748871
2-methylquinoline;naphthalene;hydrochloride
CID 175029103
dichloroplatinum;bis(2-methylquinoline)
CID 50909727
2-methylquinoline;quinoline-2-carboxamide
CID 174829911
2-methylquinoline;pyrimidine
CID 174933863
potassium;hydride;2-methylquinoline;tritetrafluoroborate
CID 175190029
butane-1,3-diol;2-methylquinoline
CID 141397242
1-chloronaphthalene;2-methylquinoline
CID 175049880
bis(2-methylquinoline);triphenylsilyloxyaluminum(2+)
CID 162162913
2-methylbenzo[b][1,8]naphthyridine
CID 118895198
3-methyl-1-benzazepin-2-one
CID 20546908
2-methylquinolin-6-ol
CID 594395

Frequently Asked Questions

What is the IUPAC name of dihydroxy(oxo)phosphanium;2-methylquinoline?
The IUPAC name of dihydroxy(oxo)phosphanium;2-methylquinoline (CID 174867800) is dihydroxy(oxo)phosphanium;2-methylquinoline.
What is the SMILES notation for dihydroxy(oxo)phosphanium;2-methylquinoline?
The canonical SMILES for dihydroxy(oxo)phosphanium;2-methylquinoline is Cc1ccc2ccccc2n1.O=[P+](O)O.
What is the InChIKey of dihydroxy(oxo)phosphanium;2-methylquinoline?
The InChIKey is NEVMAFOMRZXJDP-UHFFFAOYSA-O. The full InChI is InChI=1S/C10H9N.HO3P/c1-8-6-7-9-4-2-3-5-10(9)11-8;1-4(2)3/h2-7H,1H3;(H-,1,2,3)/p+1.
What are the key properties of dihydroxy(oxo)phosphanium;2-methylquinoline?
dihydroxy(oxo)phosphanium;2-methylquinoline has a molecular weight of 224.18 g/mol, XLogP of 2.17, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for dihydroxy(oxo)phosphanium;2-methylquinoline is sourced from PubChem (CID 174867800), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).