1-(2-chloro-6-ethoxyphenyl)ethanamine

C10H14ClNO — CID 130164060

IUPAC1-(2-chloro-6-ethoxyphenyl)ethanamine
SMILESCCOc1cccc(Cl)c1C(C)N
InChIInChI=1S/C10H14ClNO/c1-3-13-9-6-4-5-8(11)10(9)7(2)12/h4-7H,3,12H2,1-2H3
InChIKeyDBLLNGGGESKESQ-UHFFFAOYSA-N
MW199.68 g/mol
LogP2.76
Rot. Bonds3

About 1-(2-chloro-6-ethoxyphenyl)ethanamine

1-(2-chloro-6-ethoxyphenyl)ethanamine (PubChem CID 130164060) has the molecular formula C10H14ClNO and a molecular weight of 199.68 g/mol. Its IUPAC name is 1-(2-chloro-6-ethoxyphenyl)ethanamine.

Molecular Properties

Compound Name1-(2-chloro-6-ethoxyphenyl)ethanamine
PubChem CID130164060
Molecular FormulaC10H14ClNO
Molecular Weight199.68 g/mol
Exact Mass199.08
IUPAC Name1-(2-chloro-6-ethoxyphenyl)ethanamine
SMILESCCOc1cccc(Cl)c1C(C)N
InChIInChI=1S/C10H14ClNO/c1-3-13-9-6-4-5-8(11)10(9)7(2)12/h4-7H,3,12H2,1-2H3
InChIKeyDBLLNGGGESKESQ-UHFFFAOYSA-N
XLogP2.76
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.68
LogP ≤ 52.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 1-(2-chloro-6-ethoxyphenyl)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

2-(2-chloro-6-ethoxyphenyl)propanal
CID 134639769
1-(3-chloro-2-ethoxyphenyl)ethanamine;hydrochloride
CID 163284852
1-(2-chloro-6-ethoxyphenyl)butan-2-amine
CID 114322005
3-ethoxy-2-propan-2-ylaniline
CID 154678316
(1S)-1-(2,6-dichlorophenyl)-2-methylbutan-1-amine;hydrochloride
CID 171217454
(1R)-1-(3-chloro-4-ethoxyphenyl)ethanamine
CID 51396913
2-chloro-2-(2,6-diethoxyphenyl)acetamide
CID 70093878
1-(2-chloro-6-fluorophenyl)ethanamine
CID 53394777
(1R)-1-(2-bromo-6-chlorophenyl)ethanamine
CID 130968340
1-[2-chloro-6-(4-ethoxyphenoxy)phenyl]propan-2-amine
CID 63816825
(1S)-1-[2-[(2,6-dichlorophenyl)methoxy]phenyl]propan-1-amine
CID 78944066
(2,6-dichlorophenyl)-(4-ethoxyphenyl)methanol
CID 61100563

Frequently Asked Questions

What is the IUPAC name of 1-(2-chloro-6-ethoxyphenyl)ethanamine?
The IUPAC name of 1-(2-chloro-6-ethoxyphenyl)ethanamine (CID 130164060) is 1-(2-chloro-6-ethoxyphenyl)ethanamine.
What is the SMILES notation for 1-(2-chloro-6-ethoxyphenyl)ethanamine?
The canonical SMILES for 1-(2-chloro-6-ethoxyphenyl)ethanamine is CCOc1cccc(Cl)c1C(C)N.
What is the InChIKey of 1-(2-chloro-6-ethoxyphenyl)ethanamine?
The InChIKey is DBLLNGGGESKESQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14ClNO/c1-3-13-9-6-4-5-8(11)10(9)7(2)12/h4-7H,3,12H2,1-2H3.
What are the key properties of 1-(2-chloro-6-ethoxyphenyl)ethanamine?
1-(2-chloro-6-ethoxyphenyl)ethanamine has a molecular weight of 199.68 g/mol, XLogP of 2.76, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-chloro-6-ethoxyphenyl)ethanamine is sourced from PubChem (CID 130164060), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).