3-ethenyl-2-(ethylideneamino)-N,N-diphenyl-1H-indol-5-amine

C24H21N3 — CID 174036081

IUPAC3-ethenyl-2-(ethylideneamino)-N,N-diphenyl-1H-indol-5-amine
SMILESC=Cc1c(N=CC)[nH]c2ccc(N(c3ccccc3)c3ccccc3)cc12
InChIInChI=1S/C24H21N3/c1-3-21-22-17-20(15-16-23(22)26-24(21)25-4-2)27(18-11-7-5-8-12-18)19-13-9-6-10-14-19/h3-17,26H,1H2,2H3
InChIKeyOUMDWILQMZDTGE-UHFFFAOYSA-N
MW351.45 g/mol
LogP7.00
Rot. Bonds5

About 3-ethenyl-2-(ethylideneamino)-N,N-diphenyl-1H-indol-5-amine

3-ethenyl-2-(ethylideneamino)-N,N-diphenyl-1H-indol-5-amine (PubChem CID 174036081) has the molecular formula C24H21N3 and a molecular weight of 351.45 g/mol. Its IUPAC name is 3-ethenyl-2-(ethylideneamino)-N,N-diphenyl-1H-indol-5-amine.

Molecular Properties

Compound Name3-ethenyl-2-(ethylideneamino)-N,N-diphenyl-1H-indol-5-amine
PubChem CID174036081
Molecular FormulaC24H21N3
Molecular Weight351.45 g/mol
Exact Mass351.17
IUPAC Name3-ethenyl-2-(ethylideneamino)-N,N-diphenyl-1H-indol-5-amine
SMILESC=Cc1c(N=CC)[nH]c2ccc(N(c3ccccc3)c3ccccc3)cc12
InChIInChI=1S/C24H21N3/c1-3-21-22-17-20(15-16-23(22)26-24(21)25-4-2)27(18-11-7-5-8-12-18)19-13-9-6-10-14-19/h3-17,26H,1H2,2H3
InChIKeyOUMDWILQMZDTGE-UHFFFAOYSA-N
XLogP7.00
TPSA31.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500351.45
LogP ≤ 57.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

6-ethenyl-N,N-diphenyl-5-[(Z)-prop-1-enyl]naphthalen-2-amine
CID 170405383
6,7-dimethyl-N-phenyl-N-(4-phenylphenyl)-9H-carbazol-3-amine
CID 143420423
2-ethenyl-N,N-dinaphthalen-1-yl-3-[(Z)-prop-1-enyl]-1H-indol-5-amine
CID 143420435
3-N,3-N,6-N,6-N-tetrakis[4-(dimethylamino)phenyl]-9H-carbazole-3,6-diamine
CID 58925352
N,N-diphenyl-9H-pyrido[3,4-b]indol-6-amine
CID 167339450
ethane;3-ethenyl-N,N-diphenylaniline
CID 123345777
4-(9H-carbazol-3-yl)-N,N-diphenylaniline;ethane
CID 144639434
9H-carbazole;bis(N,N-diphenylaniline)
CID 174838898
N-[4-(9H-carbazol-3-yl)phenyl]-2-ethenyl-3,3-dimethyl-N-(4-phenylphenyl)-1-[(Z)-prop-1-enyl]inden-5-amine
CID 145426312
3-ethenyl-N-(3-ethenylphenyl)-N-phenylaniline
CID 58099838
N-phenyl-N-[4-[6-[4-[N-(9,9'-spirobi[fluorene]-2-yl)anilino]phenyl]-9H-carbazol-3-yl]phenyl]-9,9'-spirobi[fluorene]-2-amine
CID 59306973
ethane;1-N,1-N,4-N,4-N-tetraphenylbenzene-1,4-diamine
CID 91310242

Frequently Asked Questions

What is the IUPAC name of 3-ethenyl-2-(ethylideneamino)-N,N-diphenyl-1H-indol-5-amine?
The IUPAC name of 3-ethenyl-2-(ethylideneamino)-N,N-diphenyl-1H-indol-5-amine (CID 174036081) is 3-ethenyl-2-(ethylideneamino)-N,N-diphenyl-1H-indol-5-amine.
What is the SMILES notation for 3-ethenyl-2-(ethylideneamino)-N,N-diphenyl-1H-indol-5-amine?
The canonical SMILES for 3-ethenyl-2-(ethylideneamino)-N,N-diphenyl-1H-indol-5-amine is C=Cc1c(N=CC)[nH]c2ccc(N(c3ccccc3)c3ccccc3)cc12.
What is the InChIKey of 3-ethenyl-2-(ethylideneamino)-N,N-diphenyl-1H-indol-5-amine?
The InChIKey is OUMDWILQMZDTGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H21N3/c1-3-21-22-17-20(15-16-23(22)26-24(21)25-4-2)27(18-11-7-5-8-12-18)19-13-9-6-10-14-19/h3-17,26H,1H2,2H3.
What are the key properties of 3-ethenyl-2-(ethylideneamino)-N,N-diphenyl-1H-indol-5-amine?
3-ethenyl-2-(ethylideneamino)-N,N-diphenyl-1H-indol-5-amine has a molecular weight of 351.45 g/mol, XLogP of 7.00, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethenyl-2-(ethylideneamino)-N,N-diphenyl-1H-indol-5-amine is sourced from PubChem (CID 174036081), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).