(5E)-2-[2-(2,3-dihydroindol-1-yl)ethenyl]-5-(2,3-dihydroindol-1-ylmethylidene)-N-methylcyclopenten-1-amine

C25H27N3 — CID 89166834

IUPAC(5E)-2-[2-(2,3-dihydroindol-1-yl)ethenyl]-5-(2,3-dihydroindol-1-ylmethylidene)-N-methylcyclopenten-1-amine
SMILESCNC1=C(C=CN2CCc3ccccc32)CC/C1=C\N1CCc2ccccc21
InChIInChI=1S/C25H27N3/c1-26-25-21(14-16-27-15-12-19-6-2-4-8-23(19)27)10-11-22(25)18-28-17-13-20-7-3-5-9-24(20)28/h2-9,14,16,18,26H,10-13,15,17H2,1H3/b16-14?,22-18+
InChIKeyLYDDNNFITMLNHO-ORHAVBHKSA-N
MW369.51 g/mol
LogP4.78
Rot. Bonds4

About (5E)-2-[2-(2,3-dihydroindol-1-yl)ethenyl]-5-(2,3-dihydroindol-1-ylmethylidene)-N-methylcyclopenten-1-amine

(5E)-2-[2-(2,3-dihydroindol-1-yl)ethenyl]-5-(2,3-dihydroindol-1-ylmethylidene)-N-methylcyclopenten-1-amine (PubChem CID 89166834) has the molecular formula C25H27N3 and a molecular weight of 369.51 g/mol. Its IUPAC name is (5E)-2-[2-(2,3-dihydroindol-1-yl)ethenyl]-5-(2,3-dihydroindol-1-ylmethylidene)-N-methylcyclopenten-1-amine.

Molecular Properties

Compound Name(5E)-2-[2-(2,3-dihydroindol-1-yl)ethenyl]-5-(2,3-dihydroindol-1-ylmethylidene)-N-methylcyclopenten-1-amine
PubChem CID89166834
Molecular FormulaC25H27N3
Molecular Weight369.51 g/mol
Exact Mass369.22
IUPAC Name(5E)-2-[2-(2,3-dihydroindol-1-yl)ethenyl]-5-(2,3-dihydroindol-1-ylmethylidene)-N-methylcyclopenten-1-amine
SMILESCNC1=C(C=CN2CCc3ccccc32)CC/C1=C\N1CCc2ccccc21
InChIInChI=1S/C25H27N3/c1-26-25-21(14-16-27-15-12-19-6-2-4-8-23(19)27)10-11-22(25)18-28-17-13-20-7-3-5-9-24(20)28/h2-9,14,16,18,26H,10-13,15,17H2,1H3/b16-14?,22-18+
InChIKeyLYDDNNFITMLNHO-ORHAVBHKSA-N
XLogP4.78
TPSA18.51 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.51
LogP ≤ 54.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (5E)-2-[2-(2,3-dihydroindol-1-yl)ethenyl]-5-(2,3-dihydroindol-1-ylmethylidene)-N-methylcyclopenten-1-amine?
The IUPAC name of (5E)-2-[2-(2,3-dihydroindol-1-yl)ethenyl]-5-(2,3-dihydroindol-1-ylmethylidene)-N-methylcyclopenten-1-amine (CID 89166834) is (5E)-2-[2-(2,3-dihydroindol-1-yl)ethenyl]-5-(2,3-dihydroindol-1-ylmethylidene)-N-methylcyclopenten-1-amine.
What is the SMILES notation for (5E)-2-[2-(2,3-dihydroindol-1-yl)ethenyl]-5-(2,3-dihydroindol-1-ylmethylidene)-N-methylcyclopenten-1-amine?
The canonical SMILES for (5E)-2-[2-(2,3-dihydroindol-1-yl)ethenyl]-5-(2,3-dihydroindol-1-ylmethylidene)-N-methylcyclopenten-1-amine is CNC1=C(C=CN2CCc3ccccc32)CC/C1=C\N1CCc2ccccc21.
What is the InChIKey of (5E)-2-[2-(2,3-dihydroindol-1-yl)ethenyl]-5-(2,3-dihydroindol-1-ylmethylidene)-N-methylcyclopenten-1-amine?
The InChIKey is LYDDNNFITMLNHO-ORHAVBHKSA-N. The full InChI is InChI=1S/C25H27N3/c1-26-25-21(14-16-27-15-12-19-6-2-4-8-23(19)27)10-11-22(25)18-28-17-13-20-7-3-5-9-24(20)28/h2-9,14,16,18,26H,10-13,15,17H2,1H3/b16-14?,22-18+.
What are the key properties of (5E)-2-[2-(2,3-dihydroindol-1-yl)ethenyl]-5-(2,3-dihydroindol-1-ylmethylidene)-N-methylcyclopenten-1-amine?
(5E)-2-[2-(2,3-dihydroindol-1-yl)ethenyl]-5-(2,3-dihydroindol-1-ylmethylidene)-N-methylcyclopenten-1-amine has a molecular weight of 369.51 g/mol, XLogP of 4.78, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (5E)-2-[2-(2,3-dihydroindol-1-yl)ethenyl]-5-(2,3-dihydroindol-1-ylmethylidene)-N-methylcyclopenten-1-amine is sourced from PubChem (CID 89166834), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).