7-methyl-3-methylidene-2,6-di(propan-2-yl)-7,8-dihydro-4H-pyrrolo[2,3-f]indole

C18H24N2 — CID 139316571

IUPAC7-methyl-3-methylidene-2,6-di(propan-2-yl)-7,8-dihydro-4H-pyrrolo[2,3-f]indole
SMILESC=C1C(C(C)C)=NC2=C1CC1=C(C2)C(C)C(C(C)C)=N1
InChIInChI=1S/C18H24N2/c1-9(2)17-11(5)13-7-16-14(8-15(13)19-17)12(6)18(20-16)10(3)4/h9-10,12H,5,7-8H2,1-4,6H3
InChIKeyURPWUTMZRQVVHG-UHFFFAOYSA-N
MW268.40 g/mol
LogP4.70
Rot. Bonds2

About 7-methyl-3-methylidene-2,6-di(propan-2-yl)-7,8-dihydro-4H-pyrrolo[2,3-f]indole

7-methyl-3-methylidene-2,6-di(propan-2-yl)-7,8-dihydro-4H-pyrrolo[2,3-f]indole (PubChem CID 139316571) has the molecular formula C18H24N2 and a molecular weight of 268.40 g/mol. Its IUPAC name is 7-methyl-3-methylidene-2,6-di(propan-2-yl)-7,8-dihydro-4H-pyrrolo[2,3-f]indole.

Molecular Properties

Compound Name7-methyl-3-methylidene-2,6-di(propan-2-yl)-7,8-dihydro-4H-pyrrolo[2,3-f]indole
PubChem CID139316571
Molecular FormulaC18H24N2
Molecular Weight268.40 g/mol
Exact Mass268.19
IUPAC Name7-methyl-3-methylidene-2,6-di(propan-2-yl)-7,8-dihydro-4H-pyrrolo[2,3-f]indole
SMILESC=C1C(C(C)C)=NC2=C1CC1=C(C2)C(C)C(C(C)C)=N1
InChIInChI=1S/C18H24N2/c1-9(2)17-11(5)13-7-16-14(8-15(13)19-17)12(6)18(20-16)10(3)4/h9-10,12H,5,7-8H2,1-4,6H3
InChIKeyURPWUTMZRQVVHG-UHFFFAOYSA-N
XLogP4.70
TPSA24.72 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.40
LogP ≤ 54.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2,6-Di(propan-2-yl)-3,4,7,8-tetrahydropyrrolo[2,3-f]indole
CID 58315943
7-Methylidene-3-pentan-3-ylidene-2,6-di(propan-2-yl)-4,8-dihydropyrrolo[2,3-f]indole
CID 139316577
CID 153588910
CID 153588910
(3E)-1-buta-1,3-dien-2-yl-4,6-dimethyl-3-(2-methylhexan-3-ylidene)-3a,4-dihydroisoindole
CID 173990495
2-cyclohexyl-5-methyl-6,7-dihydro-5H-indole
CID 174599108
5-methyl-4-octyl-4H-carbazole
CID 19384574
N-(2,4,6-trimethyl-3,5-dimethylidenecyclohexen-1-yl)propan-2-imine
CID 143231905

Frequently Asked Questions

What is the IUPAC name of 7-methyl-3-methylidene-2,6-di(propan-2-yl)-7,8-dihydro-4H-pyrrolo[2,3-f]indole?
The IUPAC name of 7-methyl-3-methylidene-2,6-di(propan-2-yl)-7,8-dihydro-4H-pyrrolo[2,3-f]indole (CID 139316571) is 7-methyl-3-methylidene-2,6-di(propan-2-yl)-7,8-dihydro-4H-pyrrolo[2,3-f]indole.
What is the SMILES notation for 7-methyl-3-methylidene-2,6-di(propan-2-yl)-7,8-dihydro-4H-pyrrolo[2,3-f]indole?
The canonical SMILES for 7-methyl-3-methylidene-2,6-di(propan-2-yl)-7,8-dihydro-4H-pyrrolo[2,3-f]indole is C=C1C(C(C)C)=NC2=C1CC1=C(C2)C(C)C(C(C)C)=N1.
What is the InChIKey of 7-methyl-3-methylidene-2,6-di(propan-2-yl)-7,8-dihydro-4H-pyrrolo[2,3-f]indole?
The InChIKey is URPWUTMZRQVVHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N2/c1-9(2)17-11(5)13-7-16-14(8-15(13)19-17)12(6)18(20-16)10(3)4/h9-10,12H,5,7-8H2,1-4,6H3.
What are the key properties of 7-methyl-3-methylidene-2,6-di(propan-2-yl)-7,8-dihydro-4H-pyrrolo[2,3-f]indole?
7-methyl-3-methylidene-2,6-di(propan-2-yl)-7,8-dihydro-4H-pyrrolo[2,3-f]indole has a molecular weight of 268.40 g/mol, XLogP of 4.70, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methyl-3-methylidene-2,6-di(propan-2-yl)-7,8-dihydro-4H-pyrrolo[2,3-f]indole is sourced from PubChem (CID 139316571), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).