1-(4-ethoxyphenyl)-1-phenylethanamine

C16H19NO — CID 62787644

IUPAC1-(4-ethoxyphenyl)-1-phenylethanamine
SMILESCCOc1ccc(C(C)(N)c2ccccc2)cc1
InChIInChI=1S/C16H19NO/c1-3-18-15-11-9-14(10-12-15)16(2,17)13-7-5-4-6-8-13/h4-12H,3,17H2,1-2H3
InChIKeyVGPUWBLVIRVSJW-UHFFFAOYSA-N
MW241.33 g/mol
LogP3.31
Rot. Bonds4

About 1-(4-ethoxyphenyl)-1-phenylethanamine

1-(4-ethoxyphenyl)-1-phenylethanamine (PubChem CID 62787644) has the molecular formula C16H19NO and a molecular weight of 241.33 g/mol. Its IUPAC name is 1-(4-ethoxyphenyl)-1-phenylethanamine.

Molecular Properties

Compound Name1-(4-ethoxyphenyl)-1-phenylethanamine
PubChem CID62787644
Molecular FormulaC16H19NO
Molecular Weight241.33 g/mol
Exact Mass241.15
IUPAC Name1-(4-ethoxyphenyl)-1-phenylethanamine
SMILESCCOc1ccc(C(C)(N)c2ccccc2)cc1
InChIInChI=1S/C16H19NO/c1-3-18-15-11-9-14(10-12-15)16(2,17)13-7-5-4-6-8-13/h4-12H,3,17H2,1-2H3
InChIKeyVGPUWBLVIRVSJW-UHFFFAOYSA-N
XLogP3.31
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.33
LogP ≤ 53.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(4-ethoxyphenyl)-1-(4-methylphenyl)ethanamine
CID 62788691
1-(4-ethoxyphenyl)-1-(3-methylphenyl)ethanamine
CID 55116130
(1S)-1-(4-methoxyphenyl)-1-phenylethanamine
CID 93047943
1,1-diphenylethanamine
CID 12761172
1-(4-ethoxyphenyl)-1-phenylbutan-1-ol
CID 62786789
ethoxybenzene chloride
CID 21193593
1-ethoxy-4-(2-methyl-1-phenylmethoxypropan-2-yl)benzene
CID 142632162
1-(1-bromo-2-methyl-2-phenylpropyl)-4-ethoxybenzene
CID 63437312
ethoxybenzene;molecular iodine
CID 67763605
ethoxybenzene;ethoxyethane
CID 67764259
1-[(4-ethoxyphenyl)methylamino]-2-phenylpropan-2-ol
CID 111121689
4-ethoxy-N-(4-ethoxyphenyl)-N-phenylaniline
CID 18996804

Frequently Asked Questions

What is the IUPAC name of 1-(4-ethoxyphenyl)-1-phenylethanamine?
The IUPAC name of 1-(4-ethoxyphenyl)-1-phenylethanamine (CID 62787644) is 1-(4-ethoxyphenyl)-1-phenylethanamine.
What is the SMILES notation for 1-(4-ethoxyphenyl)-1-phenylethanamine?
The canonical SMILES for 1-(4-ethoxyphenyl)-1-phenylethanamine is CCOc1ccc(C(C)(N)c2ccccc2)cc1.
What is the InChIKey of 1-(4-ethoxyphenyl)-1-phenylethanamine?
The InChIKey is VGPUWBLVIRVSJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19NO/c1-3-18-15-11-9-14(10-12-15)16(2,17)13-7-5-4-6-8-13/h4-12H,3,17H2,1-2H3.
What are the key properties of 1-(4-ethoxyphenyl)-1-phenylethanamine?
1-(4-ethoxyphenyl)-1-phenylethanamine has a molecular weight of 241.33 g/mol, XLogP of 3.31, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-ethoxyphenyl)-1-phenylethanamine is sourced from PubChem (CID 62787644), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).