(3Z)-3-[(E)-3-phenylprop-2-enylidene]indole

C17H13N — CID 6158640

IUPAC(3Z)-3-[(E)-3-phenylprop-2-enylidene]indole
SMILESC1=Nc2ccccc2/C1=C/C=C/c1ccccc1
InChIInChI=1S/C17H13N/c1-2-7-14(8-3-1)9-6-10-15-13-18-17-12-5-4-11-16(15)17/h1-13H/b9-6+,15-10+
InChIKeyXECYSFBWKRFNAW-UJHPFZFGSA-N
MW231.30 g/mol
LogP4.50
Rot. Bonds2

About (3Z)-3-[(E)-3-phenylprop-2-enylidene]indole

(3Z)-3-[(E)-3-phenylprop-2-enylidene]indole (PubChem CID 6158640) has the molecular formula C17H13N and a molecular weight of 231.30 g/mol. Its IUPAC name is (3Z)-3-[(E)-3-phenylprop-2-enylidene]indole.

Molecular Properties

Compound Name(3Z)-3-[(E)-3-phenylprop-2-enylidene]indole
PubChem CID6158640
Molecular FormulaC17H13N
Molecular Weight231.30 g/mol
Exact Mass231.10
IUPAC Name(3Z)-3-[(E)-3-phenylprop-2-enylidene]indole
SMILESC1=Nc2ccccc2/C1=C/C=C/c1ccccc1
InChIInChI=1S/C17H13N/c1-2-7-14(8-3-1)9-6-10-15-13-18-17-12-5-4-11-16(15)17/h1-13H/b9-6+,15-10+
InChIKeyXECYSFBWKRFNAW-UJHPFZFGSA-N
XLogP4.50
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.30
LogP ≤ 54.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

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[(1Z,3E,5Z,7E)-8-phenylocta-1,3,5,7-tetraenyl]benzene
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(3E)-3-[(E)-3-phenylprop-2-enylidene]-2-benzofuran-1-one
CID 927453
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3-(4-phenylbuta-1,3-dienyl)pyridine
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Frequently Asked Questions

What is the IUPAC name of (3Z)-3-[(E)-3-phenylprop-2-enylidene]indole?
The IUPAC name of (3Z)-3-[(E)-3-phenylprop-2-enylidene]indole (CID 6158640) is (3Z)-3-[(E)-3-phenylprop-2-enylidene]indole.
What is the SMILES notation for (3Z)-3-[(E)-3-phenylprop-2-enylidene]indole?
The canonical SMILES for (3Z)-3-[(E)-3-phenylprop-2-enylidene]indole is C1=Nc2ccccc2/C1=C/C=C/c1ccccc1.
What is the InChIKey of (3Z)-3-[(E)-3-phenylprop-2-enylidene]indole?
The InChIKey is XECYSFBWKRFNAW-UJHPFZFGSA-N. The full InChI is InChI=1S/C17H13N/c1-2-7-14(8-3-1)9-6-10-15-13-18-17-12-5-4-11-16(15)17/h1-13H/b9-6+,15-10+.
What are the key properties of (3Z)-3-[(E)-3-phenylprop-2-enylidene]indole?
(3Z)-3-[(E)-3-phenylprop-2-enylidene]indole has a molecular weight of 231.30 g/mol, XLogP of 4.50, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (3Z)-3-[(E)-3-phenylprop-2-enylidene]indole is sourced from PubChem (CID 6158640), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).