(3Z)-1-ethyl-2-methylidene-3-[(4-methylphenyl)methylidene]indole

C19H19N — CID 88576648

IUPAC(3Z)-1-ethyl-2-methylidene-3-[(4-methylphenyl)methylidene]indole
SMILESC=c1/c(=C\c2ccc(C)cc2)c2ccccc2n1CC
InChIInChI=1S/C19H19N/c1-4-20-15(3)18(17-7-5-6-8-19(17)20)13-16-11-9-14(2)10-12-16/h5-13H,3-4H2,1-2H3/b18-13+
InChIKeyXIQBBUPOLITYML-QGOAFFKASA-N
MW261.37 g/mol
LogP3.21
Rot. Bonds2

About (3Z)-1-ethyl-2-methylidene-3-[(4-methylphenyl)methylidene]indole

(3Z)-1-ethyl-2-methylidene-3-[(4-methylphenyl)methylidene]indole (PubChem CID 88576648) has the molecular formula C19H19N and a molecular weight of 261.37 g/mol. Its IUPAC name is (3Z)-1-ethyl-2-methylidene-3-[(4-methylphenyl)methylidene]indole.

Molecular Properties

Compound Name(3Z)-1-ethyl-2-methylidene-3-[(4-methylphenyl)methylidene]indole
PubChem CID88576648
Molecular FormulaC19H19N
Molecular Weight261.37 g/mol
Exact Mass261.15
IUPAC Name(3Z)-1-ethyl-2-methylidene-3-[(4-methylphenyl)methylidene]indole
SMILESC=c1/c(=C\c2ccc(C)cc2)c2ccccc2n1CC
InChIInChI=1S/C19H19N/c1-4-20-15(3)18(17-7-5-6-8-19(17)20)13-16-11-9-14(2)10-12-16/h5-13H,3-4H2,1-2H3/b18-13+
InChIKeyXIQBBUPOLITYML-QGOAFFKASA-N
XLogP3.21
TPSA4.93 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.37
LogP ≤ 53.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

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CID 23052627
9-ethyl-2-[7-(9-ethylcarbazol-2-yl)triphenylen-2-yl]carbazole
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N-[(9-ethylcarbazol-3-yl)methylideneamino]-N,4-dimethylbenzenesulfonamide
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CID 22900133
N-[(9-ethylcarbazol-3-yl)methyl]-1-(4-methylphenyl)methanamine;hydrochloride
CID 17332553
3-(3-ethylidene-2-methylideneindol-1-yl)-N,N-dimethylpropan-1-amine
CID 91345374
1-ethyl-3-phenyl-2-sulfanylidenequinazolin-4-one
CID 14043337
2-[(E)-2-[4-[3-[4-(2-carbazol-9-ylethenyl)phenyl]-5-[4-[(E)-2-carbazol-9-ylethenyl]phenyl]phenyl]phenyl]ethenyl]-9-ethylcarbazole
CID 118404920
9-ethylcarbazole-2,3-dicarbaldehyde
CID 174480322
[5-(9-ethylcarbazol-3-yl)-1H-pyrrol-2-yl]-bis(2,4,6-trimethylphenyl)borane
CID 102288178

Frequently Asked Questions

What is the IUPAC name of (3Z)-1-ethyl-2-methylidene-3-[(4-methylphenyl)methylidene]indole?
The IUPAC name of (3Z)-1-ethyl-2-methylidene-3-[(4-methylphenyl)methylidene]indole (CID 88576648) is (3Z)-1-ethyl-2-methylidene-3-[(4-methylphenyl)methylidene]indole.
What is the SMILES notation for (3Z)-1-ethyl-2-methylidene-3-[(4-methylphenyl)methylidene]indole?
The canonical SMILES for (3Z)-1-ethyl-2-methylidene-3-[(4-methylphenyl)methylidene]indole is C=c1/c(=C\c2ccc(C)cc2)c2ccccc2n1CC.
What is the InChIKey of (3Z)-1-ethyl-2-methylidene-3-[(4-methylphenyl)methylidene]indole?
The InChIKey is XIQBBUPOLITYML-QGOAFFKASA-N. The full InChI is InChI=1S/C19H19N/c1-4-20-15(3)18(17-7-5-6-8-19(17)20)13-16-11-9-14(2)10-12-16/h5-13H,3-4H2,1-2H3/b18-13+.
What are the key properties of (3Z)-1-ethyl-2-methylidene-3-[(4-methylphenyl)methylidene]indole?
(3Z)-1-ethyl-2-methylidene-3-[(4-methylphenyl)methylidene]indole has a molecular weight of 261.37 g/mol, XLogP of 3.21, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (3Z)-1-ethyl-2-methylidene-3-[(4-methylphenyl)methylidene]indole is sourced from PubChem (CID 88576648), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).