(2Z)-N-(4-phenyldiazenylphenyl)-2-(1,3,3-trimethylindol-2-ylidene)ethanimine

C25H24N4 — CID 30223942

IUPAC(2Z)-N-(4-phenyldiazenylphenyl)-2-(1,3,3-trimethylindol-2-ylidene)ethanimine
SMILESCN1/C(=C\C=N\c2ccc(/N=N/c3ccccc3)cc2)C(C)(C)c2ccccc21
InChIInChI=1S/C25H24N4/c1-25(2)22-11-7-8-12-23(22)29(3)24(25)17-18-26-19-13-15-21(16-14-19)28-27-20-9-5-4-6-10-20/h4-18H,1-3H3/b24-17-,26-18+,28-27+
InChIKeyFWCWWVUIXUJDSI-IYSRQEJVSA-N
MW380.50 g/mol
LogP7.12
Rot. Bonds4

About (2Z)-N-(4-phenyldiazenylphenyl)-2-(1,3,3-trimethylindol-2-ylidene)ethanimine

(2Z)-N-(4-phenyldiazenylphenyl)-2-(1,3,3-trimethylindol-2-ylidene)ethanimine (PubChem CID 30223942) has the molecular formula C25H24N4 and a molecular weight of 380.50 g/mol. Its IUPAC name is (2Z)-N-(4-phenyldiazenylphenyl)-2-(1,3,3-trimethylindol-2-ylidene)ethanimine.

Molecular Properties

Compound Name(2Z)-N-(4-phenyldiazenylphenyl)-2-(1,3,3-trimethylindol-2-ylidene)ethanimine
PubChem CID30223942
Molecular FormulaC25H24N4
Molecular Weight380.50 g/mol
Exact Mass380.20
IUPAC Name(2Z)-N-(4-phenyldiazenylphenyl)-2-(1,3,3-trimethylindol-2-ylidene)ethanimine
SMILESCN1/C(=C\C=N\c2ccc(/N=N/c3ccccc3)cc2)C(C)(C)c2ccccc21
InChIInChI=1S/C25H24N4/c1-25(2)22-11-7-8-12-23(22)29(3)24(25)17-18-26-19-13-15-21(16-14-19)28-27-20-9-5-4-6-10-20/h4-18H,1-3H3/b24-17-,26-18+,28-27+
InChIKeyFWCWWVUIXUJDSI-IYSRQEJVSA-N
XLogP7.12
TPSA40.32 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500380.50
LogP ≤ 57.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}

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Related Compounds

(2Z)-N-(4-tert-butylphenyl)-2-(1,3,3-trimethylindol-2-ylidene)ethanimine
CID 2334878
(2Z)-N-pyridin-4-yl-2-(1,3,3-trimethylindol-2-ylidene)ethanimine
CID 21179247
N-(4-methoxyphenyl)-2-(1,3,3-trimethylindol-2-ylidene)ethanimine;hydrochloride
CID 170839740
N-naphthalen-2-yl-2-(1,3,3-trimethylindol-2-ylidene)ethanimine
CID 2830673
(2Z)-N-[4-(difluoromethylsulfanyl)phenyl]-2-(1,3,3-trimethylindol-2-ylidene)ethanimine
CID 2376526
(2Z)-1,3,3-trimethyl-2-[(2E)-2-(1,3,3-trimethylindol-2-ylidene)ethylidene]indole
CID 18806794
N-(4-iodo-3-methylphenyl)-2-(1,3,3-trimethylindol-2-ylidene)ethanimine
CID 4087183
acetic acid;N-(4-ethoxyphenyl)-2-(1,3,3-trimethylindol-2-ylidene)ethanimine
CID 170845454
6-[2-(1,3,3-trimethylindol-2-ylidene)ethylideneamino]-3H-1,3-benzoxazol-2-one
CID 1205751
N-(2-tert-butylphenyl)-2-(1,3,3-trimethylindol-2-ylidene)ethanimine
CID 5215508
(2E)-N-(2,3,4-trifluorophenyl)-2-(1,3,3-trimethylindol-2-ylidene)ethanimine
CID 2346200
(E,2Z)-N-(1,3-thiazol-2-yl)-2-(1,3,3-trimethylindol-2-ylidene)ethanimine
CID 21179241

Frequently Asked Questions

What is the IUPAC name of (2Z)-N-(4-phenyldiazenylphenyl)-2-(1,3,3-trimethylindol-2-ylidene)ethanimine?
The IUPAC name of (2Z)-N-(4-phenyldiazenylphenyl)-2-(1,3,3-trimethylindol-2-ylidene)ethanimine (CID 30223942) is (2Z)-N-(4-phenyldiazenylphenyl)-2-(1,3,3-trimethylindol-2-ylidene)ethanimine.
What is the SMILES notation for (2Z)-N-(4-phenyldiazenylphenyl)-2-(1,3,3-trimethylindol-2-ylidene)ethanimine?
The canonical SMILES for (2Z)-N-(4-phenyldiazenylphenyl)-2-(1,3,3-trimethylindol-2-ylidene)ethanimine is CN1/C(=C\C=N\c2ccc(/N=N/c3ccccc3)cc2)C(C)(C)c2ccccc21.
What is the InChIKey of (2Z)-N-(4-phenyldiazenylphenyl)-2-(1,3,3-trimethylindol-2-ylidene)ethanimine?
The InChIKey is FWCWWVUIXUJDSI-IYSRQEJVSA-N. The full InChI is InChI=1S/C25H24N4/c1-25(2)22-11-7-8-12-23(22)29(3)24(25)17-18-26-19-13-15-21(16-14-19)28-27-20-9-5-4-6-10-20/h4-18H,1-3H3/b24-17-,26-18+,28-27+.
What are the key properties of (2Z)-N-(4-phenyldiazenylphenyl)-2-(1,3,3-trimethylindol-2-ylidene)ethanimine?
(2Z)-N-(4-phenyldiazenylphenyl)-2-(1,3,3-trimethylindol-2-ylidene)ethanimine has a molecular weight of 380.50 g/mol, XLogP of 7.12, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2Z)-N-(4-phenyldiazenylphenyl)-2-(1,3,3-trimethylindol-2-ylidene)ethanimine is sourced from PubChem (CID 30223942), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).