methylhydrazine;3-(1H-phenanthro[9,10-d]imidazol-2-yl)-1H-indole-6-carbaldehyde

C25H21N5O — CID 143655539

IUPACmethylhydrazine;3-(1H-phenanthro[9,10-d]imidazol-2-yl)-1H-indole-6-carbaldehyde
SMILESCNN.O=Cc1ccc2c(-c3nc4c5ccccc5c5ccccc5c4[nH]3)c[nH]c2c1
InChIInChI=1S/C24H15N3O.CH6N2/c28-13-14-9-10-17-20(12-25-21(17)11-14)24-26-22-18-7-3-1-5-15(18)16-6-2-4-8-19(16)23(22)27-24;1-3-2/h1-13,25H,(H,26,27);3H,2H2,1H3
InChIKeyUZEBXYSCOPZHLF-UHFFFAOYSA-N
MW407.48 g/mol
LogP4.91
Rot. Bonds2

About methylhydrazine;3-(1H-phenanthro[9,10-d]imidazol-2-yl)-1H-indole-6-carbaldehyde

methylhydrazine;3-(1H-phenanthro[9,10-d]imidazol-2-yl)-1H-indole-6-carbaldehyde (PubChem CID 143655539) has the molecular formula C25H21N5O and a molecular weight of 407.48 g/mol. Its IUPAC name is methylhydrazine;3-(1H-phenanthro[9,10-d]imidazol-2-yl)-1H-indole-6-carbaldehyde.

Molecular Properties

Compound Namemethylhydrazine;3-(1H-phenanthro[9,10-d]imidazol-2-yl)-1H-indole-6-carbaldehyde
PubChem CID143655539
Molecular FormulaC25H21N5O
Molecular Weight407.48 g/mol
Exact Mass407.17
IUPAC Namemethylhydrazine;3-(1H-phenanthro[9,10-d]imidazol-2-yl)-1H-indole-6-carbaldehyde
SMILESCNN.O=Cc1ccc2c(-c3nc4c5ccccc5c5ccccc5c4[nH]3)c[nH]c2c1
InChIInChI=1S/C24H15N3O.CH6N2/c28-13-14-9-10-17-20(12-25-21(17)11-14)24-26-22-18-7-3-1-5-15(18)16-6-2-4-8-19(16)23(22)27-24;1-3-2/h1-13,25H,(H,26,27);3H,2H2,1H3
InChIKeyUZEBXYSCOPZHLF-UHFFFAOYSA-N
XLogP4.91
TPSA99.59 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500407.48
LogP ≤ 54.91
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

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Related Compounds

3-(1H-phenanthro[9,10-d]imidazol-2-yl)-1H-indole-6-carbaldehyde
CID 143655540
2-(1H-indol-3-yl)-5-methyl-1H-phenanthro[9,10-d]imidazole
CID 88972587
2-(5-bromo-1H-indol-3-yl)-1H-phenanthro[9,10-d]imidazole;ethane
CID 143047895
1-[2-(1H-indol-3-yl)-1H-phenanthro[9,10-d]imidazol-5-yl]-3-phenylthiourea
CID 58882302
CID 89277516
CID 89277516
2-(5-ethenyl-1H-indol-3-yl)-1H-imidazo[4,5-f][1,10]phenanthroline
CID 89277515
CID 89232067
CID 89232067
2-amino-N-[2-(5-bromo-1H-indol-3-yl)-1H-phenanthro[9,10-d]imidazol-5-yl]acetamide
CID 58882242
2-(5-bromo-1H-indol-3-yl)-N-[(5-bromo-1H-indol-3-yl)methyl]-1H-phenanthro[9,10-d]imidazol-5-amine
CID 58882286
2-phenyl-1H-phenanthro[9,10-d]imidazole
CID 626372
3-bromo-1H-indole-6-carbaldehyde
CID 74787786
4-(1H-indol-3-yl)-10,10-dimethyl-11-oxa-3,5-diazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(17),2(6),4,7(12),13,15-hexaene
CID 10044491

Frequently Asked Questions

What is the IUPAC name of methylhydrazine;3-(1H-phenanthro[9,10-d]imidazol-2-yl)-1H-indole-6-carbaldehyde?
The IUPAC name of methylhydrazine;3-(1H-phenanthro[9,10-d]imidazol-2-yl)-1H-indole-6-carbaldehyde (CID 143655539) is methylhydrazine;3-(1H-phenanthro[9,10-d]imidazol-2-yl)-1H-indole-6-carbaldehyde.
What is the SMILES notation for methylhydrazine;3-(1H-phenanthro[9,10-d]imidazol-2-yl)-1H-indole-6-carbaldehyde?
The canonical SMILES for methylhydrazine;3-(1H-phenanthro[9,10-d]imidazol-2-yl)-1H-indole-6-carbaldehyde is CNN.O=Cc1ccc2c(-c3nc4c5ccccc5c5ccccc5c4[nH]3)c[nH]c2c1.
What is the InChIKey of methylhydrazine;3-(1H-phenanthro[9,10-d]imidazol-2-yl)-1H-indole-6-carbaldehyde?
The InChIKey is UZEBXYSCOPZHLF-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H15N3O.CH6N2/c28-13-14-9-10-17-20(12-25-21(17)11-14)24-26-22-18-7-3-1-5-15(18)16-6-2-4-8-19(16)23(22)27-24;1-3-2/h1-13,25H,(H,26,27);3H,2H2,1H3.
What are the key properties of methylhydrazine;3-(1H-phenanthro[9,10-d]imidazol-2-yl)-1H-indole-6-carbaldehyde?
methylhydrazine;3-(1H-phenanthro[9,10-d]imidazol-2-yl)-1H-indole-6-carbaldehyde has a molecular weight of 407.48 g/mol, XLogP of 4.91, 2 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for methylhydrazine;3-(1H-phenanthro[9,10-d]imidazol-2-yl)-1H-indole-6-carbaldehyde is sourced from PubChem (CID 143655539), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).