2-ethyl-2-methoxy-1-(4-phenylphenyl)butan-1-amine

C19H25NO — CID 116760612

IUPAC2-ethyl-2-methoxy-1-(4-phenylphenyl)butan-1-amine
SMILESCCC(CC)(OC)C(N)c1ccc(-c2ccccc2)cc1
InChIInChI=1S/C19H25NO/c1-4-19(5-2,21-3)18(20)17-13-11-16(12-14-17)15-9-7-6-8-10-15/h6-14,18H,4-5,20H2,1-3H3
InChIKeyJXTXYYLXOUDPLS-UHFFFAOYSA-N
MW283.42 g/mol
LogP4.56
Rot. Bonds6

About 2-ethyl-2-methoxy-1-(4-phenylphenyl)butan-1-amine

2-ethyl-2-methoxy-1-(4-phenylphenyl)butan-1-amine (PubChem CID 116760612) has the molecular formula C19H25NO and a molecular weight of 283.42 g/mol. Its IUPAC name is 2-ethyl-2-methoxy-1-(4-phenylphenyl)butan-1-amine.

Molecular Properties

Compound Name2-ethyl-2-methoxy-1-(4-phenylphenyl)butan-1-amine
PubChem CID116760612
Molecular FormulaC19H25NO
Molecular Weight283.42 g/mol
Exact Mass283.19
IUPAC Name2-ethyl-2-methoxy-1-(4-phenylphenyl)butan-1-amine
SMILESCCC(CC)(OC)C(N)c1ccc(-c2ccccc2)cc1
InChIInChI=1S/C19H25NO/c1-4-19(5-2,21-3)18(20)17-13-11-16(12-14-17)15-9-7-6-8-10-15/h6-14,18H,4-5,20H2,1-3H3
InChIKeyJXTXYYLXOUDPLS-UHFFFAOYSA-N
XLogP4.56
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.42
LogP ≤ 54.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-ethyl-2-methoxy-1-(4-phenylphenyl)butan-1-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-2-methoxy-1-(4-phenylphenyl)butan-1-amine?
The IUPAC name of 2-ethyl-2-methoxy-1-(4-phenylphenyl)butan-1-amine (CID 116760612) is 2-ethyl-2-methoxy-1-(4-phenylphenyl)butan-1-amine.
What is the SMILES notation for 2-ethyl-2-methoxy-1-(4-phenylphenyl)butan-1-amine?
The canonical SMILES for 2-ethyl-2-methoxy-1-(4-phenylphenyl)butan-1-amine is CCC(CC)(OC)C(N)c1ccc(-c2ccccc2)cc1.
What is the InChIKey of 2-ethyl-2-methoxy-1-(4-phenylphenyl)butan-1-amine?
The InChIKey is JXTXYYLXOUDPLS-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25NO/c1-4-19(5-2,21-3)18(20)17-13-11-16(12-14-17)15-9-7-6-8-10-15/h6-14,18H,4-5,20H2,1-3H3.
What are the key properties of 2-ethyl-2-methoxy-1-(4-phenylphenyl)butan-1-amine?
2-ethyl-2-methoxy-1-(4-phenylphenyl)butan-1-amine has a molecular weight of 283.42 g/mol, XLogP of 4.56, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-2-methoxy-1-(4-phenylphenyl)butan-1-amine is sourced from PubChem (CID 116760612), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).