2-phenyl-1-(2,4,6-trimethylphenyl)butan-2-amine

C19H25N — CID 63408240

IUPAC2-phenyl-1-(2,4,6-trimethylphenyl)butan-2-amine
SMILESCCC(N)(Cc1c(C)cc(C)cc1C)c1ccccc1
InChIInChI=1S/C19H25N/c1-5-19(20,17-9-7-6-8-10-17)13-18-15(3)11-14(2)12-16(18)4/h6-12H,5,13,20H2,1-4H3
InChIKeyVRLYZHZFVFRSNH-UHFFFAOYSA-N
MW267.42 g/mol
LogP4.42
Rot. Bonds4

About 2-phenyl-1-(2,4,6-trimethylphenyl)butan-2-amine

2-phenyl-1-(2,4,6-trimethylphenyl)butan-2-amine (PubChem CID 63408240) has the molecular formula C19H25N and a molecular weight of 267.42 g/mol. Its IUPAC name is 2-phenyl-1-(2,4,6-trimethylphenyl)butan-2-amine.

Molecular Properties

Compound Name2-phenyl-1-(2,4,6-trimethylphenyl)butan-2-amine
PubChem CID63408240
Molecular FormulaC19H25N
Molecular Weight267.42 g/mol
Exact Mass267.20
IUPAC Name2-phenyl-1-(2,4,6-trimethylphenyl)butan-2-amine
SMILESCCC(N)(Cc1c(C)cc(C)cc1C)c1ccccc1
InChIInChI=1S/C19H25N/c1-5-19(20,17-9-7-6-8-10-17)13-18-15(3)11-14(2)12-16(18)4/h6-12H,5,13,20H2,1-4H3
InChIKeyVRLYZHZFVFRSNH-UHFFFAOYSA-N
XLogP4.42
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.42
LogP ≤ 54.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-phenyl-1-(2,4,6-trimethylphenyl)butan-2-amine?
The IUPAC name of 2-phenyl-1-(2,4,6-trimethylphenyl)butan-2-amine (CID 63408240) is 2-phenyl-1-(2,4,6-trimethylphenyl)butan-2-amine.
What is the SMILES notation for 2-phenyl-1-(2,4,6-trimethylphenyl)butan-2-amine?
The canonical SMILES for 2-phenyl-1-(2,4,6-trimethylphenyl)butan-2-amine is CCC(N)(Cc1c(C)cc(C)cc1C)c1ccccc1.
What is the InChIKey of 2-phenyl-1-(2,4,6-trimethylphenyl)butan-2-amine?
The InChIKey is VRLYZHZFVFRSNH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25N/c1-5-19(20,17-9-7-6-8-10-17)13-18-15(3)11-14(2)12-16(18)4/h6-12H,5,13,20H2,1-4H3.
What are the key properties of 2-phenyl-1-(2,4,6-trimethylphenyl)butan-2-amine?
2-phenyl-1-(2,4,6-trimethylphenyl)butan-2-amine has a molecular weight of 267.42 g/mol, XLogP of 4.42, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenyl-1-(2,4,6-trimethylphenyl)butan-2-amine is sourced from PubChem (CID 63408240), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).