1-(2,5-dichlorophenyl)-2-propan-2-yloxyethanamine

C11H15Cl2NO — CID 105013246

IUPAC1-(2,5-dichlorophenyl)-2-propan-2-yloxyethanamine
SMILESCC(C)OCC(N)c1cc(Cl)ccc1Cl
InChIInChI=1S/C11H15Cl2NO/c1-7(2)15-6-11(14)9-5-8(12)3-4-10(9)13/h3-5,7,11H,6,14H2,1-2H3
InChIKeyLQCQDSCUXGVPOD-UHFFFAOYSA-N
MW248.15 g/mol
LogP3.42
Rot. Bonds4

About 1-(2,5-dichlorophenyl)-2-propan-2-yloxyethanamine

1-(2,5-dichlorophenyl)-2-propan-2-yloxyethanamine (PubChem CID 105013246) has the molecular formula C11H15Cl2NO and a molecular weight of 248.15 g/mol. Its IUPAC name is 1-(2,5-dichlorophenyl)-2-propan-2-yloxyethanamine.

Molecular Properties

Compound Name1-(2,5-dichlorophenyl)-2-propan-2-yloxyethanamine
PubChem CID105013246
Molecular FormulaC11H15Cl2NO
Molecular Weight248.15 g/mol
Exact Mass247.05
IUPAC Name1-(2,5-dichlorophenyl)-2-propan-2-yloxyethanamine
SMILESCC(C)OCC(N)c1cc(Cl)ccc1Cl
InChIInChI=1S/C11H15Cl2NO/c1-7(2)15-6-11(14)9-5-8(12)3-4-10(9)13/h3-5,7,11H,6,14H2,1-2H3
InChIKeyLQCQDSCUXGVPOD-UHFFFAOYSA-N
XLogP3.42
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.15
LogP ≤ 53.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 1-(2,5-dichlorophenyl)-2-propan-2-yloxyethanamine 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

(1S)-1-(2,5-dichlorophenyl)propan-1-amine
CID 26342063
(1S)-1-(3-chloro-4-fluorophenyl)-2-propan-2-yloxyethanamine
CID 118021269
1-(2,5-dichlorophenyl)-3-methoxypropan-1-amine
CID 62790378
(1R)-1-(2,5-dichlorophenyl)propane-1,3-diamine
CID 131122702
(1R)-1-(2,5-dichlorophenyl)-3-fluoropropan-1-amine
CID 131460461
1-(2,5-dichlorophenyl)-3-ethylpentan-1-amine
CID 105028229
1-(2-bromo-4-fluorophenyl)-2-propan-2-yloxyethanamine
CID 105013400
(1R)-1-(2,5-dichlorophenyl)pentane-1,5-diamine
CID 171202730
1-(2,4-dibromophenyl)-2-propan-2-yloxyethanamine
CID 107946374
1-[2-[(1R)-1-aminoethyl]-4-chlorophenoxy]-3-propan-2-yloxypropan-2-ol
CID 63988427
2-propan-2-yloxy-1-(4-propan-2-ylphenyl)ethanamine
CID 43184569
1-(2,5-dichlorophenyl)-2-methoxy-3-methylbutan-1-amine
CID 116719639

Frequently Asked Questions

What is the IUPAC name of 1-(2,5-dichlorophenyl)-2-propan-2-yloxyethanamine?
The IUPAC name of 1-(2,5-dichlorophenyl)-2-propan-2-yloxyethanamine (CID 105013246) is 1-(2,5-dichlorophenyl)-2-propan-2-yloxyethanamine.
What is the SMILES notation for 1-(2,5-dichlorophenyl)-2-propan-2-yloxyethanamine?
The canonical SMILES for 1-(2,5-dichlorophenyl)-2-propan-2-yloxyethanamine is CC(C)OCC(N)c1cc(Cl)ccc1Cl.
What is the InChIKey of 1-(2,5-dichlorophenyl)-2-propan-2-yloxyethanamine?
The InChIKey is LQCQDSCUXGVPOD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15Cl2NO/c1-7(2)15-6-11(14)9-5-8(12)3-4-10(9)13/h3-5,7,11H,6,14H2,1-2H3.
What are the key properties of 1-(2,5-dichlorophenyl)-2-propan-2-yloxyethanamine?
1-(2,5-dichlorophenyl)-2-propan-2-yloxyethanamine has a molecular weight of 248.15 g/mol, XLogP of 3.42, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,5-dichlorophenyl)-2-propan-2-yloxyethanamine is sourced from PubChem (CID 105013246), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).