1-cyclopropyl-2-(2,4-dichlorophenyl)ethanamine

C11H13Cl2N — CID 62602404

IUPAC1-cyclopropyl-2-(2,4-dichlorophenyl)ethanamine
SMILESNC(Cc1ccc(Cl)cc1Cl)C1CC1
InChIInChI=1S/C11H13Cl2N/c12-9-4-3-8(10(13)6-9)5-11(14)7-1-2-7/h3-4,6-7,11H,1-2,5,14H2
InChIKeyXRHDWQLNNUKUDR-UHFFFAOYSA-N
MW230.14 g/mol
LogP3.27
Rot. Bonds3

About 1-cyclopropyl-2-(2,4-dichlorophenyl)ethanamine

1-cyclopropyl-2-(2,4-dichlorophenyl)ethanamine (PubChem CID 62602404) has the molecular formula C11H13Cl2N and a molecular weight of 230.14 g/mol. Its IUPAC name is 1-cyclopropyl-2-(2,4-dichlorophenyl)ethanamine.

Molecular Properties

Compound Name1-cyclopropyl-2-(2,4-dichlorophenyl)ethanamine
PubChem CID62602404
Molecular FormulaC11H13Cl2N
Molecular Weight230.14 g/mol
Exact Mass229.04
IUPAC Name1-cyclopropyl-2-(2,4-dichlorophenyl)ethanamine
SMILESNC(Cc1ccc(Cl)cc1Cl)C1CC1
InChIInChI=1S/C11H13Cl2N/c12-9-4-3-8(10(13)6-9)5-11(14)7-1-2-7/h3-4,6-7,11H,1-2,5,14H2
InChIKeyXRHDWQLNNUKUDR-UHFFFAOYSA-N
XLogP3.27
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.14
LogP ≤ 53.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

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2-(2-chloro-4-methylphenyl)-1-cyclohexylethanamine
CID 106866830
2-amino-3-(2,4-dichlorophenyl)propan-1-ol
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1-cyclopropyl-2-(2,3-dichlorophenyl)ethanamine
CID 107308371
2-(4-chloro-2-nitrophenyl)-1-cyclopentylethanamine
CID 112570226
2-(2-chloro-4-fluorophenyl)-1-(thiolan-3-yl)ethanamine
CID 105133425
4-amino-1-(4-chloro-2-fluorophenyl)-4-cyclopropylbutan-2-one
CID 114863568
2-chloro-2-cyclopropyl-N-[(2,4-dichlorophenyl)methyl]ethanamine
CID 65029881
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Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-2-(2,4-dichlorophenyl)ethanamine?
The IUPAC name of 1-cyclopropyl-2-(2,4-dichlorophenyl)ethanamine (CID 62602404) is 1-cyclopropyl-2-(2,4-dichlorophenyl)ethanamine.
What is the SMILES notation for 1-cyclopropyl-2-(2,4-dichlorophenyl)ethanamine?
The canonical SMILES for 1-cyclopropyl-2-(2,4-dichlorophenyl)ethanamine is NC(Cc1ccc(Cl)cc1Cl)C1CC1.
What is the InChIKey of 1-cyclopropyl-2-(2,4-dichlorophenyl)ethanamine?
The InChIKey is XRHDWQLNNUKUDR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13Cl2N/c12-9-4-3-8(10(13)6-9)5-11(14)7-1-2-7/h3-4,6-7,11H,1-2,5,14H2.
What are the key properties of 1-cyclopropyl-2-(2,4-dichlorophenyl)ethanamine?
1-cyclopropyl-2-(2,4-dichlorophenyl)ethanamine has a molecular weight of 230.14 g/mol, XLogP of 3.27, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-2-(2,4-dichlorophenyl)ethanamine is sourced from PubChem (CID 62602404), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).