N-[2-(2,4,6-trimethylphenyl)ethyl]propan-2-amine

C14H23N — CID 62549698

IUPACN-[2-(2,4,6-trimethylphenyl)ethyl]propan-2-amine
SMILESCc1cc(C)c(CCNC(C)C)c(C)c1
InChIInChI=1S/C14H23N/c1-10(2)15-7-6-14-12(4)8-11(3)9-13(14)5/h8-10,15H,6-7H2,1-5H3
InChIKeyUMPJZEISMAWHQY-UHFFFAOYSA-N
MW205.34 g/mol
LogP3.15
Rot. Bonds4

About N-[2-(2,4,6-trimethylphenyl)ethyl]propan-2-amine

N-[2-(2,4,6-trimethylphenyl)ethyl]propan-2-amine (PubChem CID 62549698) has the molecular formula C14H23N and a molecular weight of 205.34 g/mol. Its IUPAC name is N-[2-(2,4,6-trimethylphenyl)ethyl]propan-2-amine.

Molecular Properties

Compound NameN-[2-(2,4,6-trimethylphenyl)ethyl]propan-2-amine
PubChem CID62549698
Molecular FormulaC14H23N
Molecular Weight205.34 g/mol
Exact Mass205.18
IUPAC NameN-[2-(2,4,6-trimethylphenyl)ethyl]propan-2-amine
SMILESCc1cc(C)c(CCNC(C)C)c(C)c1
InChIInChI=1S/C14H23N/c1-10(2)15-7-6-14-12(4)8-11(3)9-13(14)5/h8-10,15H,6-7H2,1-5H3
InChIKeyUMPJZEISMAWHQY-UHFFFAOYSA-N
XLogP3.15
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.34
LogP ≤ 53.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-[2-(2,4,6-trimethylphenyl)ethyl]propan-2-amine?
The IUPAC name of N-[2-(2,4,6-trimethylphenyl)ethyl]propan-2-amine (CID 62549698) is N-[2-(2,4,6-trimethylphenyl)ethyl]propan-2-amine.
What is the SMILES notation for N-[2-(2,4,6-trimethylphenyl)ethyl]propan-2-amine?
The canonical SMILES for N-[2-(2,4,6-trimethylphenyl)ethyl]propan-2-amine is Cc1cc(C)c(CCNC(C)C)c(C)c1.
What is the InChIKey of N-[2-(2,4,6-trimethylphenyl)ethyl]propan-2-amine?
The InChIKey is UMPJZEISMAWHQY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N/c1-10(2)15-7-6-14-12(4)8-11(3)9-13(14)5/h8-10,15H,6-7H2,1-5H3.
What are the key properties of N-[2-(2,4,6-trimethylphenyl)ethyl]propan-2-amine?
N-[2-(2,4,6-trimethylphenyl)ethyl]propan-2-amine has a molecular weight of 205.34 g/mol, XLogP of 3.15, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2,4,6-trimethylphenyl)ethyl]propan-2-amine is sourced from PubChem (CID 62549698), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).