2-(6,7-dimethyl-1H-indol-3-yl)cyclopentan-1-amine

C15H20N2 — CID 54319398

IUPAC2-(6,7-dimethyl-1H-indol-3-yl)cyclopentan-1-amine
SMILESCc1ccc2c(C3CCCC3N)c[nH]c2c1C
InChIInChI=1S/C15H20N2/c1-9-6-7-12-13(8-17-15(12)10(9)2)11-4-3-5-14(11)16/h6-8,11,14,17H,3-5,16H2,1-2H3
InChIKeySQOIFPNDABYPPV-UHFFFAOYSA-N
MW228.34 g/mol
LogP3.38
Rot. Bonds1

About 2-(6,7-dimethyl-1H-indol-3-yl)cyclopentan-1-amine

2-(6,7-dimethyl-1H-indol-3-yl)cyclopentan-1-amine (PubChem CID 54319398) has the molecular formula C15H20N2 and a molecular weight of 228.34 g/mol. Its IUPAC name is 2-(6,7-dimethyl-1H-indol-3-yl)cyclopentan-1-amine.

Molecular Properties

Compound Name2-(6,7-dimethyl-1H-indol-3-yl)cyclopentan-1-amine
PubChem CID54319398
Molecular FormulaC15H20N2
Molecular Weight228.34 g/mol
Exact Mass228.16
IUPAC Name2-(6,7-dimethyl-1H-indol-3-yl)cyclopentan-1-amine
SMILESCc1ccc2c(C3CCCC3N)c[nH]c2c1C
InChIInChI=1S/C15H20N2/c1-9-6-7-12-13(8-17-15(12)10(9)2)11-4-3-5-14(11)16/h6-8,11,14,17H,3-5,16H2,1-2H3
InChIKeySQOIFPNDABYPPV-UHFFFAOYSA-N
XLogP3.38
TPSA41.81 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.34
LogP ≤ 53.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-(6,7-dimethyl-1H-indol-3-yl)cyclopentan-1-amine?
The IUPAC name of 2-(6,7-dimethyl-1H-indol-3-yl)cyclopentan-1-amine (CID 54319398) is 2-(6,7-dimethyl-1H-indol-3-yl)cyclopentan-1-amine.
What is the SMILES notation for 2-(6,7-dimethyl-1H-indol-3-yl)cyclopentan-1-amine?
The canonical SMILES for 2-(6,7-dimethyl-1H-indol-3-yl)cyclopentan-1-amine is Cc1ccc2c(C3CCCC3N)c[nH]c2c1C.
What is the InChIKey of 2-(6,7-dimethyl-1H-indol-3-yl)cyclopentan-1-amine?
The InChIKey is SQOIFPNDABYPPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2/c1-9-6-7-12-13(8-17-15(12)10(9)2)11-4-3-5-14(11)16/h6-8,11,14,17H,3-5,16H2,1-2H3.
What are the key properties of 2-(6,7-dimethyl-1H-indol-3-yl)cyclopentan-1-amine?
2-(6,7-dimethyl-1H-indol-3-yl)cyclopentan-1-amine has a molecular weight of 228.34 g/mol, XLogP of 3.38, 1 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6,7-dimethyl-1H-indol-3-yl)cyclopentan-1-amine is sourced from PubChem (CID 54319398), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).