2,3-diphenylcyclopenten-1-amine

C17H17N — CID 68894764

IUPAC2,3-diphenylcyclopenten-1-amine
SMILESNC1=C(c2ccccc2)C(c2ccccc2)CC1
InChIInChI=1S/C17H17N/c18-16-12-11-15(13-7-3-1-4-8-13)17(16)14-9-5-2-6-10-14/h1-10,15H,11-12,18H2
InChIKeyRMASFYWDUFEPSL-UHFFFAOYSA-N
MW235.33 g/mol
LogP3.93
Rot. Bonds2

About 2,3-diphenylcyclopenten-1-amine

2,3-diphenylcyclopenten-1-amine (PubChem CID 68894764) has the molecular formula C17H17N and a molecular weight of 235.33 g/mol. Its IUPAC name is 2,3-diphenylcyclopenten-1-amine.

Molecular Properties

Compound Name2,3-diphenylcyclopenten-1-amine
PubChem CID68894764
Molecular FormulaC17H17N
Molecular Weight235.33 g/mol
Exact Mass235.14
IUPAC Name2,3-diphenylcyclopenten-1-amine
SMILESNC1=C(c2ccccc2)C(c2ccccc2)CC1
InChIInChI=1S/C17H17N/c18-16-12-11-15(13-7-3-1-4-8-13)17(16)14-9-5-2-6-10-14/h1-10,15H,11-12,18H2
InChIKeyRMASFYWDUFEPSL-UHFFFAOYSA-N
XLogP3.93
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.33
LogP ≤ 53.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2,3-diphenylcyclopenten-1-amine?
The IUPAC name of 2,3-diphenylcyclopenten-1-amine (CID 68894764) is 2,3-diphenylcyclopenten-1-amine.
What is the SMILES notation for 2,3-diphenylcyclopenten-1-amine?
The canonical SMILES for 2,3-diphenylcyclopenten-1-amine is NC1=C(c2ccccc2)C(c2ccccc2)CC1.
What is the InChIKey of 2,3-diphenylcyclopenten-1-amine?
The InChIKey is RMASFYWDUFEPSL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17N/c18-16-12-11-15(13-7-3-1-4-8-13)17(16)14-9-5-2-6-10-14/h1-10,15H,11-12,18H2.
What are the key properties of 2,3-diphenylcyclopenten-1-amine?
2,3-diphenylcyclopenten-1-amine has a molecular weight of 235.33 g/mol, XLogP of 3.93, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-diphenylcyclopenten-1-amine is sourced from PubChem (CID 68894764), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).