2-[2-(8-phenylimidazo[4,5-c]quinolin-1-yl)phenyl]-1-phosphanylethanimine

C24H19N4P — CID 142830757

IUPAC2-[2-(8-phenylimidazo[4,5-c]quinolin-1-yl)phenyl]-1-phosphanylethanimine
SMILES[H]/N=C(\P)Cc1ccccc1-n1cnc2cnc3ccc(-c4ccccc4)cc3c21
InChIInChI=1S/C24H19N4P/c25-23(29)13-18-8-4-5-9-22(18)28-15-27-21-14-26-20-11-10-17(12-19(20)24(21)28)16-6-2-1-3-7-16/h1-12,14-15,25H,13,29H2/b25-23-
InChIKeyMHMAMAJGYYKHFW-BZZOAKBMSA-N
MW394.42 g/mol
LogP5.64
Rot. Bonds4

About 2-[2-(8-phenylimidazo[4,5-c]quinolin-1-yl)phenyl]-1-phosphanylethanimine

2-[2-(8-phenylimidazo[4,5-c]quinolin-1-yl)phenyl]-1-phosphanylethanimine (PubChem CID 142830757) has the molecular formula C24H19N4P and a molecular weight of 394.42 g/mol. Its IUPAC name is 2-[2-(8-phenylimidazo[4,5-c]quinolin-1-yl)phenyl]-1-phosphanylethanimine.

Molecular Properties

Compound Name2-[2-(8-phenylimidazo[4,5-c]quinolin-1-yl)phenyl]-1-phosphanylethanimine
PubChem CID142830757
Molecular FormulaC24H19N4P
Molecular Weight394.42 g/mol
Exact Mass394.13
IUPAC Name2-[2-(8-phenylimidazo[4,5-c]quinolin-1-yl)phenyl]-1-phosphanylethanimine
SMILES[H]/N=C(\P)Cc1ccccc1-n1cnc2cnc3ccc(-c4ccccc4)cc3c21
InChIInChI=1S/C24H19N4P/c25-23(29)13-18-8-4-5-9-22(18)28-15-27-21-14-26-20-11-10-17(12-19(20)24(21)28)16-6-2-1-3-7-16/h1-12,14-15,25H,13,29H2/b25-23-
InChIKeyMHMAMAJGYYKHFW-BZZOAKBMSA-N
XLogP5.64
TPSA54.56 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500394.42
LogP ≤ 55.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'phosphor', 'substructure': 'N/A'}

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Related Compounds

(NE)-N-[2-[2-(8-phenylimidazo[4,5-c]quinolin-1-yl)phenyl]-1-phosphanylethylidene]hydroxylamine
CID 142830737
2-[2-(8-phenylimidazo[4,5-c]quinolin-1-yl)phenyl]ethanamine
CID 10361421
1-(2-fluorophenyl)-8-pyridin-3-ylimidazo[4,5-c]quinoline
CID 158039592
3-[1-(2-fluorophenyl)imidazo[4,5-c]quinolin-8-yl]benzaldehyde
CID 159172326
1-(2-fluorophenyl)-8-[3-[(4-methylpiperazin-1-yl)methyl]phenyl]imidazo[4,5-c]quinoline
CID 11328446
8-chloro-1-(2-chlorophenyl)imidazo[4,5-c]quinoline
CID 10448328
1-(2-fluorophenyl)-8-(2,3,4-trimethoxyphenyl)imidazo[4,5-c]quinoline
CID 11224139
3-[3-chloro-4-(8-thiophen-2-ylimidazo[4,5-c]quinolin-1-yl)phenyl]propanenitrile
CID 69156254
1-(2-ethylphenyl)-3-methyl-8-pyridin-3-ylimidazo[4,5-c]quinolin-2-one
CID 11978091
2-[4-(8-thiophen-2-ylimidazo[4,5-c]quinolin-1-yl)phenyl]acetonitrile
CID 11314587
2-[2-chloro-4-(8-thiophen-2-ylimidazo[4,5-c]quinolin-1-yl)phenyl]acetonitrile
CID 11211762
8-(1,3-benzodioxol-5-yl)-1-[3-chloro-4-[2-(4,5-dihydro-1H-imidazol-2-yl)ethyl]phenyl]imidazo[4,5-c]quinoline
CID 11454761

Frequently Asked Questions

What is the IUPAC name of 2-[2-(8-phenylimidazo[4,5-c]quinolin-1-yl)phenyl]-1-phosphanylethanimine?
The IUPAC name of 2-[2-(8-phenylimidazo[4,5-c]quinolin-1-yl)phenyl]-1-phosphanylethanimine (CID 142830757) is 2-[2-(8-phenylimidazo[4,5-c]quinolin-1-yl)phenyl]-1-phosphanylethanimine.
What is the SMILES notation for 2-[2-(8-phenylimidazo[4,5-c]quinolin-1-yl)phenyl]-1-phosphanylethanimine?
The canonical SMILES for 2-[2-(8-phenylimidazo[4,5-c]quinolin-1-yl)phenyl]-1-phosphanylethanimine is [H]/N=C(\P)Cc1ccccc1-n1cnc2cnc3ccc(-c4ccccc4)cc3c21.
What is the InChIKey of 2-[2-(8-phenylimidazo[4,5-c]quinolin-1-yl)phenyl]-1-phosphanylethanimine?
The InChIKey is MHMAMAJGYYKHFW-BZZOAKBMSA-N. The full InChI is InChI=1S/C24H19N4P/c25-23(29)13-18-8-4-5-9-22(18)28-15-27-21-14-26-20-11-10-17(12-19(20)24(21)28)16-6-2-1-3-7-16/h1-12,14-15,25H,13,29H2/b25-23-.
What are the key properties of 2-[2-(8-phenylimidazo[4,5-c]quinolin-1-yl)phenyl]-1-phosphanylethanimine?
2-[2-(8-phenylimidazo[4,5-c]quinolin-1-yl)phenyl]-1-phosphanylethanimine has a molecular weight of 394.42 g/mol, XLogP of 5.64, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(8-phenylimidazo[4,5-c]quinolin-1-yl)phenyl]-1-phosphanylethanimine is sourced from PubChem (CID 142830757), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).