2-[4-[2-(2-aminoethyl)phenyl]phenyl]ethanamine

C16H20N2 — CID 122383957

IUPAC2-[4-[2-(2-aminoethyl)phenyl]phenyl]ethanamine
SMILESNCCc1ccc(-c2ccccc2CCN)cc1
InChIInChI=1S/C16H20N2/c17-11-9-13-5-7-15(8-6-13)16-4-2-1-3-14(16)10-12-18/h1-8H,9-12,17-18H2
InChIKeyDABNDOKFXGSBEG-UHFFFAOYSA-N
MW240.35 g/mol
LogP2.36
Rot. Bonds5

About 2-[4-[2-(2-aminoethyl)phenyl]phenyl]ethanamine

2-[4-[2-(2-aminoethyl)phenyl]phenyl]ethanamine (PubChem CID 122383957) has the molecular formula C16H20N2 and a molecular weight of 240.35 g/mol. Its IUPAC name is 2-[4-[2-(2-aminoethyl)phenyl]phenyl]ethanamine.

Molecular Properties

Compound Name2-[4-[2-(2-aminoethyl)phenyl]phenyl]ethanamine
PubChem CID122383957
Molecular FormulaC16H20N2
Molecular Weight240.35 g/mol
Exact Mass240.16
IUPAC Name2-[4-[2-(2-aminoethyl)phenyl]phenyl]ethanamine
SMILESNCCc1ccc(-c2ccccc2CCN)cc1
InChIInChI=1S/C16H20N2/c17-11-9-13-5-7-15(8-6-13)16-4-2-1-3-14(16)10-12-18/h1-8H,9-12,17-18H2
InChIKeyDABNDOKFXGSBEG-UHFFFAOYSA-N
XLogP2.36
TPSA52.04 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.35
LogP ≤ 52.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-[4-[2-(trifluoromethyl)phenyl]phenyl]ethanamine
CID 82039542
methyl 4-[2-(2-aminoethyl)phenyl]benzoate
CID 1393592
4-[2-(3-aminopropyl)phenyl]phenol
CID 83384327
2-(4-phenylphenyl)ethanamine;(4-phenylphenyl)methanamine
CID 160539387
2-[4-(2-phenylethyl)phenyl]ethanamine
CID 15036636
3-[2-(4-bromophenyl)phenyl]propan-1-amine;hydrochloride
CID 174475593
2-[4-(2-aminoethyl)phenyl]ethanamine;hydroiodide
CID 175484243
2-[4-(2-aminoethyl)phenyl]ethanamine;hydrochloride
CID 68536204
2-[2-(3-chlorophenyl)phenyl]ethanamine;hydrochloride
CID 164885899
2-[2-(3-fluorophenyl)phenyl]ethanamine;hydrochloride
CID 164885898
azane;2-phenylethanamine
CID 23506485
[4-[2-(2-aminoethyl)phenyl]phenyl]-(3-bromophenyl)methanone
CID 174780430

Frequently Asked Questions

What is the IUPAC name of 2-[4-[2-(2-aminoethyl)phenyl]phenyl]ethanamine?
The IUPAC name of 2-[4-[2-(2-aminoethyl)phenyl]phenyl]ethanamine (CID 122383957) is 2-[4-[2-(2-aminoethyl)phenyl]phenyl]ethanamine.
What is the SMILES notation for 2-[4-[2-(2-aminoethyl)phenyl]phenyl]ethanamine?
The canonical SMILES for 2-[4-[2-(2-aminoethyl)phenyl]phenyl]ethanamine is NCCc1ccc(-c2ccccc2CCN)cc1.
What is the InChIKey of 2-[4-[2-(2-aminoethyl)phenyl]phenyl]ethanamine?
The InChIKey is DABNDOKFXGSBEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2/c17-11-9-13-5-7-15(8-6-13)16-4-2-1-3-14(16)10-12-18/h1-8H,9-12,17-18H2.
What are the key properties of 2-[4-[2-(2-aminoethyl)phenyl]phenyl]ethanamine?
2-[4-[2-(2-aminoethyl)phenyl]phenyl]ethanamine has a molecular weight of 240.35 g/mol, XLogP of 2.36, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[2-(2-aminoethyl)phenyl]phenyl]ethanamine is sourced from PubChem (CID 122383957), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).