3,3-dimethyl-1-(4-phenylphenyl)cyclopentan-1-amine

C19H23N — CID 80692373

IUPAC3,3-dimethyl-1-(4-phenylphenyl)cyclopentan-1-amine
SMILESCC1(C)CCC(N)(c2ccc(-c3ccccc3)cc2)C1
InChIInChI=1S/C19H23N/c1-18(2)12-13-19(20,14-18)17-10-8-16(9-11-17)15-6-4-3-5-7-15/h3-11H,12-14,20H2,1-2H3
InChIKeyYRLKXUXQEABILC-UHFFFAOYSA-N
MW265.40 g/mol
LogP4.72
Rot. Bonds2

About 3,3-dimethyl-1-(4-phenylphenyl)cyclopentan-1-amine

3,3-dimethyl-1-(4-phenylphenyl)cyclopentan-1-amine (PubChem CID 80692373) has the molecular formula C19H23N and a molecular weight of 265.40 g/mol. Its IUPAC name is 3,3-dimethyl-1-(4-phenylphenyl)cyclopentan-1-amine.

Molecular Properties

Compound Name3,3-dimethyl-1-(4-phenylphenyl)cyclopentan-1-amine
PubChem CID80692373
Molecular FormulaC19H23N
Molecular Weight265.40 g/mol
Exact Mass265.18
IUPAC Name3,3-dimethyl-1-(4-phenylphenyl)cyclopentan-1-amine
SMILESCC1(C)CCC(N)(c2ccc(-c3ccccc3)cc2)C1
InChIInChI=1S/C19H23N/c1-18(2)12-13-19(20,14-18)17-10-8-16(9-11-17)15-6-4-3-5-7-15/h3-11H,12-14,20H2,1-2H3
InChIKeyYRLKXUXQEABILC-UHFFFAOYSA-N
XLogP4.72
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.40
LogP ≤ 54.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 3,3-dimethyl-1-(4-phenylphenyl)cyclopentan-1-amine?
The IUPAC name of 3,3-dimethyl-1-(4-phenylphenyl)cyclopentan-1-amine (CID 80692373) is 3,3-dimethyl-1-(4-phenylphenyl)cyclopentan-1-amine.
What is the SMILES notation for 3,3-dimethyl-1-(4-phenylphenyl)cyclopentan-1-amine?
The canonical SMILES for 3,3-dimethyl-1-(4-phenylphenyl)cyclopentan-1-amine is CC1(C)CCC(N)(c2ccc(-c3ccccc3)cc2)C1.
What is the InChIKey of 3,3-dimethyl-1-(4-phenylphenyl)cyclopentan-1-amine?
The InChIKey is YRLKXUXQEABILC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N/c1-18(2)12-13-19(20,14-18)17-10-8-16(9-11-17)15-6-4-3-5-7-15/h3-11H,12-14,20H2,1-2H3.
What are the key properties of 3,3-dimethyl-1-(4-phenylphenyl)cyclopentan-1-amine?
3,3-dimethyl-1-(4-phenylphenyl)cyclopentan-1-amine has a molecular weight of 265.40 g/mol, XLogP of 4.72, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3,3-dimethyl-1-(4-phenylphenyl)cyclopentan-1-amine is sourced from PubChem (CID 80692373), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).