2,3-bis(ethenyl)-1H-indene;ethane;9-methylcarbazole

C28H29N — CID 144597079

IUPAC2,3-bis(ethenyl)-1H-indene;ethane;9-methylcarbazole
SMILESC=CC1=C(C=C)c2ccccc2C1.CC.Cn1c2ccccc2c2ccccc21
InChIInChI=1S/C13H11N.C13H12.C2H6/c1-14-12-8-4-2-6-10(12)11-7-3-5-9-13(11)14;1-3-10-9-11-7-5-6-8-13(11)12(10)4-2;1-2/h2-9H,1H3;3-8H,1-2,9H2;1-2H3
InChIKeyIDCYICBTYCFNCS-UHFFFAOYSA-N
MW379.55 g/mol
LogP7.73
Rot. Bonds2

About 2,3-bis(ethenyl)-1H-indene;ethane;9-methylcarbazole

2,3-bis(ethenyl)-1H-indene;ethane;9-methylcarbazole (PubChem CID 144597079) has the molecular formula C28H29N and a molecular weight of 379.55 g/mol. Its IUPAC name is 2,3-bis(ethenyl)-1H-indene;ethane;9-methylcarbazole.

Molecular Properties

Compound Name2,3-bis(ethenyl)-1H-indene;ethane;9-methylcarbazole
PubChem CID144597079
Molecular FormulaC28H29N
Molecular Weight379.55 g/mol
Exact Mass379.23
IUPAC Name2,3-bis(ethenyl)-1H-indene;ethane;9-methylcarbazole
SMILESC=CC1=C(C=C)c2ccccc2C1.CC.Cn1c2ccccc2c2ccccc21
InChIInChI=1S/C13H11N.C13H12.C2H6/c1-14-12-8-4-2-6-10(12)11-7-3-5-9-13(11)14;1-3-10-9-11-7-5-6-8-13(11)12(10)4-2;1-2/h2-9H,1H3;3-8H,1-2,9H2;1-2H3
InChIKeyIDCYICBTYCFNCS-UHFFFAOYSA-N
XLogP7.73
TPSA4.93 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500379.55
LogP ≤ 57.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2,3-bis(ethenyl)-1H-indene;ethane;9-methylcarbazole?
The IUPAC name of 2,3-bis(ethenyl)-1H-indene;ethane;9-methylcarbazole (CID 144597079) is 2,3-bis(ethenyl)-1H-indene;ethane;9-methylcarbazole.
What is the SMILES notation for 2,3-bis(ethenyl)-1H-indene;ethane;9-methylcarbazole?
The canonical SMILES for 2,3-bis(ethenyl)-1H-indene;ethane;9-methylcarbazole is C=CC1=C(C=C)c2ccccc2C1.CC.Cn1c2ccccc2c2ccccc21.
What is the InChIKey of 2,3-bis(ethenyl)-1H-indene;ethane;9-methylcarbazole?
The InChIKey is IDCYICBTYCFNCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11N.C13H12.C2H6/c1-14-12-8-4-2-6-10(12)11-7-3-5-9-13(11)14;1-3-10-9-11-7-5-6-8-13(11)12(10)4-2;1-2/h2-9H,1H3;3-8H,1-2,9H2;1-2H3.
What are the key properties of 2,3-bis(ethenyl)-1H-indene;ethane;9-methylcarbazole?
2,3-bis(ethenyl)-1H-indene;ethane;9-methylcarbazole has a molecular weight of 379.55 g/mol, XLogP of 7.73, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-bis(ethenyl)-1H-indene;ethane;9-methylcarbazole is sourced from PubChem (CID 144597079), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).