(E)-1-(3-phenylphenyl)pent-2-en-2-amine

C17H19N — CID 142087219

IUPAC(E)-1-(3-phenylphenyl)pent-2-en-2-amine
SMILESCC/C=C(/N)Cc1cccc(-c2ccccc2)c1
InChIInChI=1S/C17H19N/c1-2-7-17(18)13-14-8-6-11-16(12-14)15-9-4-3-5-10-15/h3-12H,2,13,18H2,1H3/b17-7+
InChIKeyXJTCYNKXUYCROJ-REZTVBANSA-N
MW237.35 g/mol
LogP4.15
Rot. Bonds4

About (E)-1-(3-phenylphenyl)pent-2-en-2-amine

(E)-1-(3-phenylphenyl)pent-2-en-2-amine (PubChem CID 142087219) has the molecular formula C17H19N and a molecular weight of 237.35 g/mol. Its IUPAC name is (E)-1-(3-phenylphenyl)pent-2-en-2-amine.

Molecular Properties

Compound Name(E)-1-(3-phenylphenyl)pent-2-en-2-amine
PubChem CID142087219
Molecular FormulaC17H19N
Molecular Weight237.35 g/mol
Exact Mass237.15
IUPAC Name(E)-1-(3-phenylphenyl)pent-2-en-2-amine
SMILESCC/C=C(/N)Cc1cccc(-c2ccccc2)c1
InChIInChI=1S/C17H19N/c1-2-7-17(18)13-14-8-6-11-16(12-14)15-9-4-3-5-10-15/h3-12H,2,13,18H2,1H3/b17-7+
InChIKeyXJTCYNKXUYCROJ-REZTVBANSA-N
XLogP4.15
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.35
LogP ≤ 54.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (E)-1-(3-phenylphenyl)pent-2-en-2-amine?
The IUPAC name of (E)-1-(3-phenylphenyl)pent-2-en-2-amine (CID 142087219) is (E)-1-(3-phenylphenyl)pent-2-en-2-amine.
What is the SMILES notation for (E)-1-(3-phenylphenyl)pent-2-en-2-amine?
The canonical SMILES for (E)-1-(3-phenylphenyl)pent-2-en-2-amine is CC/C=C(/N)Cc1cccc(-c2ccccc2)c1.
What is the InChIKey of (E)-1-(3-phenylphenyl)pent-2-en-2-amine?
The InChIKey is XJTCYNKXUYCROJ-REZTVBANSA-N. The full InChI is InChI=1S/C17H19N/c1-2-7-17(18)13-14-8-6-11-16(12-14)15-9-4-3-5-10-15/h3-12H,2,13,18H2,1H3/b17-7+.
What are the key properties of (E)-1-(3-phenylphenyl)pent-2-en-2-amine?
(E)-1-(3-phenylphenyl)pent-2-en-2-amine has a molecular weight of 237.35 g/mol, XLogP of 4.15, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-1-(3-phenylphenyl)pent-2-en-2-amine is sourced from PubChem (CID 142087219), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).