4-methyl-3-methylidene-1,2-dihydroisoindole

C10H11N — CID 137483328

IUPAC4-methyl-3-methylidene-1,2-dihydroisoindole
SMILESC=C1NCc2cccc(C)c21
InChIInChI=1S/C10H11N/c1-7-4-3-5-9-6-11-8(2)10(7)9/h3-5,11H,2,6H2,1H3
InChIKeyJDBXPYRCMSIGCK-UHFFFAOYSA-N
MW145.20 g/mol
LogP2.07
Rot. Bonds

About 4-methyl-3-methylidene-1,2-dihydroisoindole

4-methyl-3-methylidene-1,2-dihydroisoindole (PubChem CID 137483328) has the molecular formula C10H11N and a molecular weight of 145.20 g/mol. Its IUPAC name is 4-methyl-3-methylidene-1,2-dihydroisoindole.

Molecular Properties

Compound Name4-methyl-3-methylidene-1,2-dihydroisoindole
PubChem CID137483328
Molecular FormulaC10H11N
Molecular Weight145.20 g/mol
Exact Mass145.09
IUPAC Name4-methyl-3-methylidene-1,2-dihydroisoindole
SMILESC=C1NCc2cccc(C)c21
InChIInChI=1S/C10H11N/c1-7-4-3-5-9-6-11-8(2)10(7)9/h3-5,11H,2,6H2,1H3
InChIKeyJDBXPYRCMSIGCK-UHFFFAOYSA-N
XLogP2.07
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.20
LogP ≤ 52.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-3-methylidene-1,2-dihydroisoindole?
The IUPAC name of 4-methyl-3-methylidene-1,2-dihydroisoindole (CID 137483328) is 4-methyl-3-methylidene-1,2-dihydroisoindole.
What is the SMILES notation for 4-methyl-3-methylidene-1,2-dihydroisoindole?
The canonical SMILES for 4-methyl-3-methylidene-1,2-dihydroisoindole is C=C1NCc2cccc(C)c21.
What is the InChIKey of 4-methyl-3-methylidene-1,2-dihydroisoindole?
The InChIKey is JDBXPYRCMSIGCK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11N/c1-7-4-3-5-9-6-11-8(2)10(7)9/h3-5,11H,2,6H2,1H3.
What are the key properties of 4-methyl-3-methylidene-1,2-dihydroisoindole?
4-methyl-3-methylidene-1,2-dihydroisoindole has a molecular weight of 145.20 g/mol, XLogP of 2.07, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-3-methylidene-1,2-dihydroisoindole is sourced from PubChem (CID 137483328), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).