1-(4-benzylphenyl)ethanamine

C15H17N — CID 3962419

IUPAC1-(4-benzylphenyl)ethanamine
SMILESCC(N)c1ccc(Cc2ccccc2)cc1
InChIInChI=1S/C15H17N/c1-12(16)15-9-7-14(8-10-15)11-13-5-3-2-4-6-13/h2-10,12H,11,16H2,1H3
InChIKeyDVJZQHKHDXZCFB-UHFFFAOYSA-N
MW211.31 g/mol
LogP3.30
Rot. Bonds3

About 1-(4-benzylphenyl)ethanamine

1-(4-benzylphenyl)ethanamine (PubChem CID 3962419) has the molecular formula C15H17N and a molecular weight of 211.31 g/mol. Its IUPAC name is 1-(4-benzylphenyl)ethanamine.

Molecular Properties

Compound Name1-(4-benzylphenyl)ethanamine
PubChem CID3962419
Molecular FormulaC15H17N
Molecular Weight211.31 g/mol
Exact Mass211.14
IUPAC Name1-(4-benzylphenyl)ethanamine
SMILESCC(N)c1ccc(Cc2ccccc2)cc1
InChIInChI=1S/C15H17N/c1-12(16)15-9-7-14(8-10-15)11-13-5-3-2-4-6-13/h2-10,12H,11,16H2,1H3
InChIKeyDVJZQHKHDXZCFB-UHFFFAOYSA-N
XLogP3.30
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.31
LogP ≤ 53.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(1S)-1-[4-[(4-ethylphenyl)methyl]phenyl]ethanamine
CID 174082683
1-(3-benzylphenyl)ethanamine
CID 69109207
(1S)-1-(4-benzylphenyl)propan-1-amine
CID 79018348
4-[[4-[(1R)-1-aminoethyl]phenyl]methyl]-N-methylaniline
CID 174101748
ethane;(1R)-1-phenylethanamine
CID 142977390
1-benzyl-4-[(4-benzylphenyl)methyl]benzene;1,4-dibenzylbenzene;ethane
CID 158067654
1,4-dibenzylbenzene;ethane
CID 91406396
(1R)-1-(4-ethylphenyl)ethanamine
CID 2063952
(1S)-1-(4-benzylphenyl)-2,2,2-trifluoroethanamine
CID 66512282
ethane;(1S)-1-[4-(phenoxymethyl)phenyl]ethanamine
CID 154659540
benzylbenzene;ethane;methanamine
CID 54117827
(1S)-1-(4-phenylphenyl)ethanamine;hydrochloride
CID 54594942

Frequently Asked Questions

What is the IUPAC name of 1-(4-benzylphenyl)ethanamine?
The IUPAC name of 1-(4-benzylphenyl)ethanamine (CID 3962419) is 1-(4-benzylphenyl)ethanamine.
What is the SMILES notation for 1-(4-benzylphenyl)ethanamine?
The canonical SMILES for 1-(4-benzylphenyl)ethanamine is CC(N)c1ccc(Cc2ccccc2)cc1.
What is the InChIKey of 1-(4-benzylphenyl)ethanamine?
The InChIKey is DVJZQHKHDXZCFB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N/c1-12(16)15-9-7-14(8-10-15)11-13-5-3-2-4-6-13/h2-10,12H,11,16H2,1H3.
What are the key properties of 1-(4-benzylphenyl)ethanamine?
1-(4-benzylphenyl)ethanamine has a molecular weight of 211.31 g/mol, XLogP of 3.30, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-benzylphenyl)ethanamine is sourced from PubChem (CID 3962419), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).