(5-bromoquinolin-8-yl)methoxy-iodophosphane

C10H8BrINOP — CID 144950979

IUPAC(5-bromoquinolin-8-yl)methoxy-iodophosphane
SMILESBrc1ccc(COPI)c2ncccc12
InChIInChI=1S/C10H8BrINOP/c11-9-4-3-7(6-14-15-12)10-8(9)2-1-5-13-10/h1-5,15H,6H2
InChIKeyMDWCEIUJDICFBU-UHFFFAOYSA-N
MW395.96 g/mol
LogP4.46
Rot. Bonds3

About (5-bromoquinolin-8-yl)methoxy-iodophosphane

(5-bromoquinolin-8-yl)methoxy-iodophosphane (PubChem CID 144950979) has the molecular formula C10H8BrINOP and a molecular weight of 395.96 g/mol. Its IUPAC name is (5-bromoquinolin-8-yl)methoxy-iodophosphane.

Molecular Properties

Compound Name(5-bromoquinolin-8-yl)methoxy-iodophosphane
PubChem CID144950979
Molecular FormulaC10H8BrINOP
Molecular Weight395.96 g/mol
Exact Mass394.86
IUPAC Name(5-bromoquinolin-8-yl)methoxy-iodophosphane
SMILESBrc1ccc(COPI)c2ncccc12
InChIInChI=1S/C10H8BrINOP/c11-9-4-3-7(6-14-15-12)10-8(9)2-1-5-13-10/h1-5,15H,6H2
InChIKeyMDWCEIUJDICFBU-UHFFFAOYSA-N
XLogP4.46
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500395.96
LogP ≤ 54.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

8-benzyl-5-bromoquinoline
CID 53421162
5-bromo-8-(1H-imidazol-2-ylmethoxymethyl)quinoline
CID 75454543
N-[(5-bromoquinolin-8-yl)methyl]-1-methylcyclopropan-1-amine
CID 115968174
4-[(5-bromoquinolin-8-yl)methylamino]phenol
CID 115959175
N-[(5-bromoquinolin-8-yl)methyl]butan-1-amine
CID 112617660
1-(5-bromoquinolin-8-yl)-N-[(2-methylpropan-2-yl)oxy]methanamine
CID 112617826
4-[[(5-bromoquinolin-8-yl)methylamino]methyl]phenol
CID 115968064
4-bromo-N-[(5-bromoquinolin-8-yl)methyl]aniline
CID 115958989
5-bromo-8-ethoxyquinoline
CID 100612531
N-[(5-bromoquinolin-8-yl)methyl]pyridin-3-amine
CID 112617652
1-(5-bromoquinolin-8-yl)-N-(pyridin-2-ylmethyl)methanamine
CID 115959018
4-(5-bromoquinolin-8-yl)-N-methylbutan-2-amine
CID 112618640

Frequently Asked Questions

What is the IUPAC name of (5-bromoquinolin-8-yl)methoxy-iodophosphane?
The IUPAC name of (5-bromoquinolin-8-yl)methoxy-iodophosphane (CID 144950979) is (5-bromoquinolin-8-yl)methoxy-iodophosphane.
What is the SMILES notation for (5-bromoquinolin-8-yl)methoxy-iodophosphane?
The canonical SMILES for (5-bromoquinolin-8-yl)methoxy-iodophosphane is Brc1ccc(COPI)c2ncccc12.
What is the InChIKey of (5-bromoquinolin-8-yl)methoxy-iodophosphane?
The InChIKey is MDWCEIUJDICFBU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8BrINOP/c11-9-4-3-7(6-14-15-12)10-8(9)2-1-5-13-10/h1-5,15H,6H2.
What are the key properties of (5-bromoquinolin-8-yl)methoxy-iodophosphane?
(5-bromoquinolin-8-yl)methoxy-iodophosphane has a molecular weight of 395.96 g/mol, XLogP of 4.46, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (5-bromoquinolin-8-yl)methoxy-iodophosphane is sourced from PubChem (CID 144950979), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).