9-ethyl-3-pyridin-2-yl-2H-carbazol-2-ide;(Z)-4-hydroxypent-3-en-2-one;platinum

C24H23N2O2Pt- — CID 139253847

IUPAC9-ethyl-3-pyridin-2-yl-2H-carbazol-2-ide;(Z)-4-hydroxypent-3-en-2-one;platinum
SMILESCC(=O)/C=C(/C)O.CCn1c2c[c-]c(-c3ccccn3)cc2c2ccccc21.[Pt]
InChIInChI=1S/C19H15N2.C5H8O2.Pt/c1-2-21-18-9-4-3-7-15(18)16-13-14(10-11-19(16)21)17-8-5-6-12-20-17;1-4(6)3-5(2)7;/h3-9,11-13H,2H2,1H3;3,6H,1-2H3;/q-1;;/b;4-3-;
InChIKeyDQXKAQQRPUGZPE-LWFKIUJUSA-N
MW566.54 g/mol
LogP5.71
Rot. Bonds3

About 9-ethyl-3-pyridin-2-yl-2H-carbazol-2-ide;(Z)-4-hydroxypent-3-en-2-one;platinum

9-ethyl-3-pyridin-2-yl-2H-carbazol-2-ide;(Z)-4-hydroxypent-3-en-2-one;platinum (PubChem CID 139253847) has the molecular formula C24H23N2O2Pt- and a molecular weight of 566.54 g/mol. Its IUPAC name is 9-ethyl-3-pyridin-2-yl-2H-carbazol-2-ide;(Z)-4-hydroxypent-3-en-2-one;platinum.

Molecular Properties

Compound Name9-ethyl-3-pyridin-2-yl-2H-carbazol-2-ide;(Z)-4-hydroxypent-3-en-2-one;platinum
PubChem CID139253847
Molecular FormulaC24H23N2O2Pt-
Molecular Weight566.54 g/mol
Exact Mass566.14
IUPAC Name9-ethyl-3-pyridin-2-yl-2H-carbazol-2-ide;(Z)-4-hydroxypent-3-en-2-one;platinum
SMILESCC(=O)/C=C(/C)O.CCn1c2c[c-]c(-c3ccccn3)cc2c2ccccc21.[Pt]
InChIInChI=1S/C19H15N2.C5H8O2.Pt/c1-2-21-18-9-4-3-7-15(18)16-13-14(10-11-19(16)21)17-8-5-6-12-20-17;1-4(6)3-5(2)7;/h3-9,11-13H,2H2,1H3;3,6H,1-2H3;/q-1;;/b;4-3-;
InChIKeyDQXKAQQRPUGZPE-LWFKIUJUSA-N
XLogP5.71
TPSA55.12 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms29
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500566.54
LogP ≤ 55.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

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Launch Full Analysis

Related Compounds

9-ethyl-2-pyridin-2-yl-3H-carbazol-3-ide;(Z)-4-hydroxypent-3-en-2-one;platinum
CID 139253848
4-hydroxypent-3-en-2-one;iridium;pentafluoro-(4-pyridin-2-ylbenzene-5-id-1-yl)-λ6-sulfane
CID 152840159
iridium(3+);9-(2-methylpropyl)-3-pyridin-2-yl-2H-carbazol-2-ide;bis(2-phenylpyridine)
CID 59500152
(Z)-4-hydroxypent-3-en-2-one;iridium;bis(9-[2-(2-methoxyethoxy)ethyl]-3-quinolin-2-yl-2H-carbazol-2-ide)
CID 139253815
(Z)-4-hydroxypent-3-en-2-one;2-phenylpyridine;rhodium
CID 58099744
bis(2-(4-ethynylbenzene-6-id-1-yl)pyridine);(Z)-4-hydroxypent-3-en-2-one;iridium
CID 139249289
(Z)-4-hydroxypent-3-en-2-one;iridium;2-(3-isocyanobenzene-6-id-1-yl)pyridine
CID 58162321
bis(1-(4-ethylbenzene-6-id-1-yl)isoquinoline);bis(4-hydroxypent-3-en-2-one);bis(iridium);bis(2-phenylpyridine)
CID 159880437
9-ethyl-3-(3-pyridin-2-ylphenyl)carbazole
CID 58435161
2-(4-ethynylbenzene-6-id-1-yl)pyridine;2-(4-ethynylbenzene-6-id-1-yl)pyridine;(Z)-4-hydroxypent-3-en-2-one;iridium;platinum;bis(tributylphosphane)
CID 139212320
[6-(3H-dibenzofuran-3-id-2-yl)-3-pyridinyl]-trimethylsilane;4-hydroxypent-3-en-2-one;iridium
CID 161124870
bis((Z)-5-hydroxy-2,2,6,6-tetramethylhept-4-en-3-one);platinum;2-(7-pyridin-2-yl-2,8-dihydrodibenzofuran-2,8-diid-3-yl)pyridine
CID 177296376

Frequently Asked Questions

What is the IUPAC name of 9-ethyl-3-pyridin-2-yl-2H-carbazol-2-ide;(Z)-4-hydroxypent-3-en-2-one;platinum?
The IUPAC name of 9-ethyl-3-pyridin-2-yl-2H-carbazol-2-ide;(Z)-4-hydroxypent-3-en-2-one;platinum (CID 139253847) is 9-ethyl-3-pyridin-2-yl-2H-carbazol-2-ide;(Z)-4-hydroxypent-3-en-2-one;platinum.
What is the SMILES notation for 9-ethyl-3-pyridin-2-yl-2H-carbazol-2-ide;(Z)-4-hydroxypent-3-en-2-one;platinum?
The canonical SMILES for 9-ethyl-3-pyridin-2-yl-2H-carbazol-2-ide;(Z)-4-hydroxypent-3-en-2-one;platinum is CC(=O)/C=C(/C)O.CCn1c2c[c-]c(-c3ccccn3)cc2c2ccccc21.[Pt].
What is the InChIKey of 9-ethyl-3-pyridin-2-yl-2H-carbazol-2-ide;(Z)-4-hydroxypent-3-en-2-one;platinum?
The InChIKey is DQXKAQQRPUGZPE-LWFKIUJUSA-N. The full InChI is InChI=1S/C19H15N2.C5H8O2.Pt/c1-2-21-18-9-4-3-7-15(18)16-13-14(10-11-19(16)21)17-8-5-6-12-20-17;1-4(6)3-5(2)7;/h3-9,11-13H,2H2,1H3;3,6H,1-2H3;/q-1;;/b;4-3-;.
What are the key properties of 9-ethyl-3-pyridin-2-yl-2H-carbazol-2-ide;(Z)-4-hydroxypent-3-en-2-one;platinum?
9-ethyl-3-pyridin-2-yl-2H-carbazol-2-ide;(Z)-4-hydroxypent-3-en-2-one;platinum has a molecular weight of 566.54 g/mol, XLogP of 5.71, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 9-ethyl-3-pyridin-2-yl-2H-carbazol-2-ide;(Z)-4-hydroxypent-3-en-2-one;platinum is sourced from PubChem (CID 139253847), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).