(2E,3Z)-2,3-di(ethylidene)-1H-benzo[g]indole

C16H15N — CID 167215822

IUPAC(2E,3Z)-2,3-di(ethylidene)-1H-benzo[g]indole
SMILESC/C=c1\c(=C/C)[nH]c2c1ccc1ccccc12
InChIInChI=1S/C16H15N/c1-3-12-14-10-9-11-7-5-6-8-13(11)16(14)17-15(12)4-2/h3-10,17H,1-2H3/b12-3-,15-4+
InChIKeyFFFRHXFJZNNOLS-LIQIKVCDSA-N
MW221.30 g/mol
LogP2.92
Rot. Bonds

About (2E,3Z)-2,3-di(ethylidene)-1H-benzo[g]indole

(2E,3Z)-2,3-di(ethylidene)-1H-benzo[g]indole (PubChem CID 167215822) has the molecular formula C16H15N and a molecular weight of 221.30 g/mol. Its IUPAC name is (2E,3Z)-2,3-di(ethylidene)-1H-benzo[g]indole.

Molecular Properties

Compound Name(2E,3Z)-2,3-di(ethylidene)-1H-benzo[g]indole
PubChem CID167215822
Molecular FormulaC16H15N
Molecular Weight221.30 g/mol
Exact Mass221.12
IUPAC Name(2E,3Z)-2,3-di(ethylidene)-1H-benzo[g]indole
SMILESC/C=c1\c(=C/C)[nH]c2c1ccc1ccccc12
InChIInChI=1S/C16H15N/c1-3-12-14-10-9-11-7-5-6-8-13(11)16(14)17-15(12)4-2/h3-10,17H,1-2H3/b12-3-,15-4+
InChIKeyFFFRHXFJZNNOLS-LIQIKVCDSA-N
XLogP2.92
TPSA15.79 Ų
H-Bond Donors1
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.30
LogP ≤ 52.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of (2E,3Z)-2,3-di(ethylidene)-1H-benzo[g]indole?
The IUPAC name of (2E,3Z)-2,3-di(ethylidene)-1H-benzo[g]indole (CID 167215822) is (2E,3Z)-2,3-di(ethylidene)-1H-benzo[g]indole.
What is the SMILES notation for (2E,3Z)-2,3-di(ethylidene)-1H-benzo[g]indole?
The canonical SMILES for (2E,3Z)-2,3-di(ethylidene)-1H-benzo[g]indole is C/C=c1\c(=C/C)[nH]c2c1ccc1ccccc12.
What is the InChIKey of (2E,3Z)-2,3-di(ethylidene)-1H-benzo[g]indole?
The InChIKey is FFFRHXFJZNNOLS-LIQIKVCDSA-N. The full InChI is InChI=1S/C16H15N/c1-3-12-14-10-9-11-7-5-6-8-13(11)16(14)17-15(12)4-2/h3-10,17H,1-2H3/b12-3-,15-4+.
What are the key properties of (2E,3Z)-2,3-di(ethylidene)-1H-benzo[g]indole?
(2E,3Z)-2,3-di(ethylidene)-1H-benzo[g]indole has a molecular weight of 221.30 g/mol, XLogP of 2.92, 0 rotatable bonds, 1 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (2E,3Z)-2,3-di(ethylidene)-1H-benzo[g]indole is sourced from PubChem (CID 167215822), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).