2-[1-[(2,4,6-trimethylphenoxy)methyl]cyclopropyl]ethanamine

C15H23NO — CID 65495410

IUPAC2-[1-[(2,4,6-trimethylphenoxy)methyl]cyclopropyl]ethanamine
SMILESCc1cc(C)c(OCC2(CCN)CC2)c(C)c1
InChIInChI=1S/C15H23NO/c1-11-8-12(2)14(13(3)9-11)17-10-15(4-5-15)6-7-16/h8-9H,4-7,10,16H2,1-3H3
InChIKeyBMKPASIDTYRZJR-UHFFFAOYSA-N
MW233.35 g/mol
LogP3.12
Rot. Bonds5

About 2-[1-[(2,4,6-trimethylphenoxy)methyl]cyclopropyl]ethanamine

2-[1-[(2,4,6-trimethylphenoxy)methyl]cyclopropyl]ethanamine (PubChem CID 65495410) has the molecular formula C15H23NO and a molecular weight of 233.35 g/mol. Its IUPAC name is 2-[1-[(2,4,6-trimethylphenoxy)methyl]cyclopropyl]ethanamine.

Molecular Properties

Compound Name2-[1-[(2,4,6-trimethylphenoxy)methyl]cyclopropyl]ethanamine
PubChem CID65495410
Molecular FormulaC15H23NO
Molecular Weight233.35 g/mol
Exact Mass233.18
IUPAC Name2-[1-[(2,4,6-trimethylphenoxy)methyl]cyclopropyl]ethanamine
SMILESCc1cc(C)c(OCC2(CCN)CC2)c(C)c1
InChIInChI=1S/C15H23NO/c1-11-8-12(2)14(13(3)9-11)17-10-15(4-5-15)6-7-16/h8-9H,4-7,10,16H2,1-3H3
InChIKeyBMKPASIDTYRZJR-UHFFFAOYSA-N
XLogP3.12
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.35
LogP ≤ 53.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-[1-[(2,4,6-trimethylphenoxy)methyl]cyclopropyl]ethanamine with MolForge

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

Launch Full Analysis

Related Compounds

1-(bromomethyl)-1-[(2,4,6-trimethylphenoxy)methyl]cycloheptane
CID 65010061
2-[1-[(2-chloro-4-methylphenoxy)methyl]cyclopropyl]ethanamine
CID 65496896
2-[1-[2-(2,4,6-trimethylphenyl)ethyl]cyclopentyl]ethanamine
CID 65300447
2-[[1-(bromomethyl)cyclopropyl]methoxy]-5-chloro-1,3-dimethylbenzene
CID 65008475
2-[1-[(2,5-dichlorophenoxy)methyl]cyclopropyl]ethanamine
CID 65498164
2-[1-[(2,5-difluorophenoxy)methyl]cyclopropyl]ethanamine
CID 65497318
2-[1-[(2,4-dichlorophenoxy)methyl]cyclopropyl]ethanamine
CID 65495619
2-[1-(naphthalen-1-yloxymethyl)cyclopropyl]ethanamine
CID 65496036
2-methyl-2-[2-(2,4,6-trimethylphenoxy)ethyl]-1,3-dioxolane
CID 82087459
2-[1-[(2-fluorophenoxy)methyl]cyclopropyl]ethanamine
CID 65497942
2-[1-[(4-chloro-3-ethylphenoxy)methyl]cyclopropyl]ethanamine
CID 65496464
N-[1-(aminomethyl)cyclopentyl]-2-(2,4,6-trimethylphenoxy)acetamide
CID 119567203

Frequently Asked Questions

What is the IUPAC name of 2-[1-[(2,4,6-trimethylphenoxy)methyl]cyclopropyl]ethanamine?
The IUPAC name of 2-[1-[(2,4,6-trimethylphenoxy)methyl]cyclopropyl]ethanamine (CID 65495410) is 2-[1-[(2,4,6-trimethylphenoxy)methyl]cyclopropyl]ethanamine.
What is the SMILES notation for 2-[1-[(2,4,6-trimethylphenoxy)methyl]cyclopropyl]ethanamine?
The canonical SMILES for 2-[1-[(2,4,6-trimethylphenoxy)methyl]cyclopropyl]ethanamine is Cc1cc(C)c(OCC2(CCN)CC2)c(C)c1.
What is the InChIKey of 2-[1-[(2,4,6-trimethylphenoxy)methyl]cyclopropyl]ethanamine?
The InChIKey is BMKPASIDTYRZJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO/c1-11-8-12(2)14(13(3)9-11)17-10-15(4-5-15)6-7-16/h8-9H,4-7,10,16H2,1-3H3.
What are the key properties of 2-[1-[(2,4,6-trimethylphenoxy)methyl]cyclopropyl]ethanamine?
2-[1-[(2,4,6-trimethylphenoxy)methyl]cyclopropyl]ethanamine has a molecular weight of 233.35 g/mol, XLogP of 3.12, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-[(2,4,6-trimethylphenoxy)methyl]cyclopropyl]ethanamine is sourced from PubChem (CID 65495410), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).