2-(4-phenylphenyl)propan-2-yloxymethanamine

C16H19NO — CID 155337382

IUPAC2-(4-phenylphenyl)propan-2-yloxymethanamine
SMILESCC(C)(OCN)c1ccc(-c2ccccc2)cc1
InChIInChI=1S/C16H19NO/c1-16(2,18-12-17)15-10-8-14(9-11-15)13-6-4-3-5-7-13/h3-11H,12,17H2,1-2H3
InChIKeyMHKHGWWXHZAXEZ-UHFFFAOYSA-N
MW241.33 g/mol
LogP3.52
Rot. Bonds4

About 2-(4-phenylphenyl)propan-2-yloxymethanamine

2-(4-phenylphenyl)propan-2-yloxymethanamine (PubChem CID 155337382) has the molecular formula C16H19NO and a molecular weight of 241.33 g/mol. Its IUPAC name is 2-(4-phenylphenyl)propan-2-yloxymethanamine.

Molecular Properties

Compound Name2-(4-phenylphenyl)propan-2-yloxymethanamine
PubChem CID155337382
Molecular FormulaC16H19NO
Molecular Weight241.33 g/mol
Exact Mass241.15
IUPAC Name2-(4-phenylphenyl)propan-2-yloxymethanamine
SMILESCC(C)(OCN)c1ccc(-c2ccccc2)cc1
InChIInChI=1S/C16H19NO/c1-16(2,18-12-17)15-10-8-14(9-11-15)13-6-4-3-5-7-13/h3-11H,12,17H2,1-2H3
InChIKeyMHKHGWWXHZAXEZ-UHFFFAOYSA-N
XLogP3.52
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 ≤ 53.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-(4-phenylphenyl)propan-2-yloxymethanamine?
The IUPAC name of 2-(4-phenylphenyl)propan-2-yloxymethanamine (CID 155337382) is 2-(4-phenylphenyl)propan-2-yloxymethanamine.
What is the SMILES notation for 2-(4-phenylphenyl)propan-2-yloxymethanamine?
The canonical SMILES for 2-(4-phenylphenyl)propan-2-yloxymethanamine is CC(C)(OCN)c1ccc(-c2ccccc2)cc1.
What is the InChIKey of 2-(4-phenylphenyl)propan-2-yloxymethanamine?
The InChIKey is MHKHGWWXHZAXEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19NO/c1-16(2,18-12-17)15-10-8-14(9-11-15)13-6-4-3-5-7-13/h3-11H,12,17H2,1-2H3.
What are the key properties of 2-(4-phenylphenyl)propan-2-yloxymethanamine?
2-(4-phenylphenyl)propan-2-yloxymethanamine has a molecular weight of 241.33 g/mol, XLogP of 3.52, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-phenylphenyl)propan-2-yloxymethanamine is sourced from PubChem (CID 155337382), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).