1-(4-chloro-2-methoxyphenyl)-2-methoxyethanamine

C10H14ClNO2 — CID 112693324

IUPAC1-(4-chloro-2-methoxyphenyl)-2-methoxyethanamine
SMILESCOCC(N)c1ccc(Cl)cc1OC
InChIInChI=1S/C10H14ClNO2/c1-13-6-9(12)8-4-3-7(11)5-10(8)14-2/h3-5,9H,6,12H2,1-2H3
InChIKeyHNFKRXSRPSLDHB-UHFFFAOYSA-N
MW215.68 g/mol
LogP1.99
Rot. Bonds4

About 1-(4-chloro-2-methoxyphenyl)-2-methoxyethanamine

1-(4-chloro-2-methoxyphenyl)-2-methoxyethanamine (PubChem CID 112693324) has the molecular formula C10H14ClNO2 and a molecular weight of 215.68 g/mol. Its IUPAC name is 1-(4-chloro-2-methoxyphenyl)-2-methoxyethanamine.

Molecular Properties

Compound Name1-(4-chloro-2-methoxyphenyl)-2-methoxyethanamine
PubChem CID112693324
Molecular FormulaC10H14ClNO2
Molecular Weight215.68 g/mol
Exact Mass215.07
IUPAC Name1-(4-chloro-2-methoxyphenyl)-2-methoxyethanamine
SMILESCOCC(N)c1ccc(Cl)cc1OC
InChIInChI=1S/C10H14ClNO2/c1-13-6-9(12)8-4-3-7(11)5-10(8)14-2/h3-5,9H,6,12H2,1-2H3
InChIKeyHNFKRXSRPSLDHB-UHFFFAOYSA-N
XLogP1.99
TPSA44.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.68
LogP ≤ 51.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(4-chloro-2-methoxyphenyl)ethanamine;hydrochloride
CID 167530953
1-(4-chloro-2-methoxyphenyl)-2-(2,6-dimethylphenyl)ethanamine
CID 105024725
1-(4-chloro-2-methoxyphenyl)-2,2-dimethylpropan-1-amine
CID 112705535
1-(4-chloro-2-methoxyphenyl)-2-(2,3-dichlorophenyl)ethanamine
CID 107309207
1-(4-chloro-2-methoxyphenyl)-2-(3-chloro-4-pyridinyl)ethanamine
CID 112655454
1-(4-chloro-2-methoxyphenyl)-2-methylprop-2-en-1-amine
CID 105005589
2-(5-chloro-2-methoxyphenyl)-3-methoxypropan-1-amine
CID 116835574
1-(2,4-dimethoxyphenyl)-2-[2-(2-methoxyethoxy)ethoxy]ethanamine
CID 104560891
1-(4-chloro-2-methoxyphenyl)propan-1-ol
CID 115787726
2-chloro-1-(5-chloro-2-methoxyphenyl)ethanamine
CID 116937510
(4-chloro-2-methoxyphenyl)-(3-ethylphenyl)methanamine
CID 105018869
1-(4-bromo-2-methoxyphenyl)-2-(2,4-dichlorophenyl)ethanamine
CID 115840317

Frequently Asked Questions

What is the IUPAC name of 1-(4-chloro-2-methoxyphenyl)-2-methoxyethanamine?
The IUPAC name of 1-(4-chloro-2-methoxyphenyl)-2-methoxyethanamine (CID 112693324) is 1-(4-chloro-2-methoxyphenyl)-2-methoxyethanamine.
What is the SMILES notation for 1-(4-chloro-2-methoxyphenyl)-2-methoxyethanamine?
The canonical SMILES for 1-(4-chloro-2-methoxyphenyl)-2-methoxyethanamine is COCC(N)c1ccc(Cl)cc1OC.
What is the InChIKey of 1-(4-chloro-2-methoxyphenyl)-2-methoxyethanamine?
The InChIKey is HNFKRXSRPSLDHB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14ClNO2/c1-13-6-9(12)8-4-3-7(11)5-10(8)14-2/h3-5,9H,6,12H2,1-2H3.
What are the key properties of 1-(4-chloro-2-methoxyphenyl)-2-methoxyethanamine?
1-(4-chloro-2-methoxyphenyl)-2-methoxyethanamine has a molecular weight of 215.68 g/mol, XLogP of 1.99, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-chloro-2-methoxyphenyl)-2-methoxyethanamine is sourced from PubChem (CID 112693324), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).