(3Z)-2-methylidene-3-(2-methylprop-2-enylidene)-1H-indole

C13H13N — CID 143173663

IUPAC(3Z)-2-methylidene-3-(2-methylprop-2-enylidene)-1H-indole
SMILESC=C(C)/C=c1\c(=C)[nH]c2ccccc12
InChIInChI=1S/C13H13N/c1-9(2)8-12-10(3)14-13-7-5-4-6-11(12)13/h4-8,14H,1,3H2,2H3/b12-8+
InChIKeyKDWBSGODFTUELU-XYOKQWHBSA-N
MW183.25 g/mol
LogP1.93
Rot. Bonds1

About (3Z)-2-methylidene-3-(2-methylprop-2-enylidene)-1H-indole

(3Z)-2-methylidene-3-(2-methylprop-2-enylidene)-1H-indole (PubChem CID 143173663) has the molecular formula C13H13N and a molecular weight of 183.25 g/mol. Its IUPAC name is (3Z)-2-methylidene-3-(2-methylprop-2-enylidene)-1H-indole.

Molecular Properties

Compound Name(3Z)-2-methylidene-3-(2-methylprop-2-enylidene)-1H-indole
PubChem CID143173663
Molecular FormulaC13H13N
Molecular Weight183.25 g/mol
Exact Mass183.10
IUPAC Name(3Z)-2-methylidene-3-(2-methylprop-2-enylidene)-1H-indole
SMILESC=C(C)/C=c1\c(=C)[nH]c2ccccc12
InChIInChI=1S/C13H13N/c1-9(2)8-12-10(3)14-13-7-5-4-6-11(12)13/h4-8,14H,1,3H2,2H3/b12-8+
InChIKeyKDWBSGODFTUELU-XYOKQWHBSA-N
XLogP1.93
TPSA15.79 Ų
H-Bond Donors1
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.25
LogP ≤ 51.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 100

Analyze (3Z)-2-methylidene-3-(2-methylprop-2-enylidene)-1H-indole with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(3Z)-2-methylidene-3-prop-2-enylidene-1H-indole
CID 142891286
(3Z)-3-(2,3-dihydro-1H-pyrrol-5-ylmethylidene)-2-methylidene-1H-indole
CID 134260540
bis(9H-carbazole);ethane
CID 145072085
9H-carbazole;ethane
CID 91098062
(3Z)-3-[(3-chloro-4-ethyl-5-methylphenyl)methylidene]-2-methylidene-1H-indole
CID 144587016
1-[2-[(Z)-prop-1-enyl]-1H-indol-3-yl]ethenol
CID 143138999
9H-carbazole
CID 66668984
2-ethylidene-3-methylidene-1H-indole
CID 131846475
bromomethane;9H-carbazole
CID 67594562
4-phenyl-3-prop-1-en-2-yl-1H-quinolin-2-one
CID 142303338
9H-carbazole;copper
CID 159878189
bis(9H-carbazole);platinum(2+)
CID 175826437

Frequently Asked Questions

What is the IUPAC name of (3Z)-2-methylidene-3-(2-methylprop-2-enylidene)-1H-indole?
The IUPAC name of (3Z)-2-methylidene-3-(2-methylprop-2-enylidene)-1H-indole (CID 143173663) is (3Z)-2-methylidene-3-(2-methylprop-2-enylidene)-1H-indole.
What is the SMILES notation for (3Z)-2-methylidene-3-(2-methylprop-2-enylidene)-1H-indole?
The canonical SMILES for (3Z)-2-methylidene-3-(2-methylprop-2-enylidene)-1H-indole is C=C(C)/C=c1\c(=C)[nH]c2ccccc12.
What is the InChIKey of (3Z)-2-methylidene-3-(2-methylprop-2-enylidene)-1H-indole?
The InChIKey is KDWBSGODFTUELU-XYOKQWHBSA-N. The full InChI is InChI=1S/C13H13N/c1-9(2)8-12-10(3)14-13-7-5-4-6-11(12)13/h4-8,14H,1,3H2,2H3/b12-8+.
What are the key properties of (3Z)-2-methylidene-3-(2-methylprop-2-enylidene)-1H-indole?
(3Z)-2-methylidene-3-(2-methylprop-2-enylidene)-1H-indole has a molecular weight of 183.25 g/mol, XLogP of 1.93, 1 rotatable bonds, 1 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (3Z)-2-methylidene-3-(2-methylprop-2-enylidene)-1H-indole is sourced from PubChem (CID 143173663), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).