1,2,3-trimethyl-8H-cyclopenta[e]indole

C14H15N — CID 169084563

IUPAC1,2,3-trimethyl-8H-cyclopenta[e]indole
SMILESCc1c(C)n(C)c2ccc3c(c12)CC=C3
InChIInChI=1S/C14H15N/c1-9-10(2)15(3)13-8-7-11-5-4-6-12(11)14(9)13/h4-5,7-8H,6H2,1-3H3
InChIKeyDCTFWXXAWGEDTI-UHFFFAOYSA-N
MW197.28 g/mol
LogP3.36
Rot. Bonds

About 1,2,3-trimethyl-8H-cyclopenta[e]indole

1,2,3-trimethyl-8H-cyclopenta[e]indole (PubChem CID 169084563) has the molecular formula C14H15N and a molecular weight of 197.28 g/mol. Its IUPAC name is 1,2,3-trimethyl-8H-cyclopenta[e]indole.

Molecular Properties

Compound Name1,2,3-trimethyl-8H-cyclopenta[e]indole
PubChem CID169084563
Molecular FormulaC14H15N
Molecular Weight197.28 g/mol
Exact Mass197.12
IUPAC Name1,2,3-trimethyl-8H-cyclopenta[e]indole
SMILESCc1c(C)n(C)c2ccc3c(c12)CC=C3
InChIInChI=1S/C14H15N/c1-9-10(2)15(3)13-8-7-11-5-4-6-12(11)14(9)13/h4-5,7-8H,6H2,1-3H3
InChIKeyDCTFWXXAWGEDTI-UHFFFAOYSA-N
XLogP3.36
TPSA4.93 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.28
LogP ≤ 53.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1,2,3-trimethyl-8H-cyclopenta[e]indole?
The IUPAC name of 1,2,3-trimethyl-8H-cyclopenta[e]indole (CID 169084563) is 1,2,3-trimethyl-8H-cyclopenta[e]indole.
What is the SMILES notation for 1,2,3-trimethyl-8H-cyclopenta[e]indole?
The canonical SMILES for 1,2,3-trimethyl-8H-cyclopenta[e]indole is Cc1c(C)n(C)c2ccc3c(c12)CC=C3.
What is the InChIKey of 1,2,3-trimethyl-8H-cyclopenta[e]indole?
The InChIKey is DCTFWXXAWGEDTI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N/c1-9-10(2)15(3)13-8-7-11-5-4-6-12(11)14(9)13/h4-5,7-8H,6H2,1-3H3.
What are the key properties of 1,2,3-trimethyl-8H-cyclopenta[e]indole?
1,2,3-trimethyl-8H-cyclopenta[e]indole has a molecular weight of 197.28 g/mol, XLogP of 3.36, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2,3-trimethyl-8H-cyclopenta[e]indole is sourced from PubChem (CID 169084563), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).