(1R)-1-[(1S,2S)-2-(2,4-dichlorophenyl)cyclopropyl]ethanamine

C11H13Cl2N — CID 28912124

IUPAC(1R)-1-[(1S,2S)-2-(2,4-dichlorophenyl)cyclopropyl]ethanamine
SMILESC[C@@H](N)[C@H]1C[C@@H]1c1ccc(Cl)cc1Cl
InChIInChI=1S/C11H13Cl2N/c1-6(14)9-5-10(9)8-3-2-7(12)4-11(8)13/h2-4,6,9-10H,5,14H2,1H3/t6-,9-,10-/m1/s1
InChIKeyKQJNWEUHGJEKFH-BDODKLCJSA-N
MW230.14 g/mol
LogP3.44
Rot. Bonds2

About (1R)-1-[(1S,2S)-2-(2,4-dichlorophenyl)cyclopropyl]ethanamine

(1R)-1-[(1S,2S)-2-(2,4-dichlorophenyl)cyclopropyl]ethanamine (PubChem CID 28912124) has the molecular formula C11H13Cl2N and a molecular weight of 230.14 g/mol. Its IUPAC name is (1R)-1-[(1S,2S)-2-(2,4-dichlorophenyl)cyclopropyl]ethanamine.

Molecular Properties

Compound Name(1R)-1-[(1S,2S)-2-(2,4-dichlorophenyl)cyclopropyl]ethanamine
PubChem CID28912124
Molecular FormulaC11H13Cl2N
Molecular Weight230.14 g/mol
Exact Mass229.04
IUPAC Name(1R)-1-[(1S,2S)-2-(2,4-dichlorophenyl)cyclopropyl]ethanamine
SMILESC[C@@H](N)[C@H]1C[C@@H]1c1ccc(Cl)cc1Cl
InChIInChI=1S/C11H13Cl2N/c1-6(14)9-5-10(9)8-3-2-7(12)4-11(8)13/h2-4,6,9-10H,5,14H2,1H3/t6-,9-,10-/m1/s1
InChIKeyKQJNWEUHGJEKFH-BDODKLCJSA-N
XLogP3.44
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.14
LogP ≤ 53.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze (1R)-1-[(1S,2S)-2-(2,4-dichlorophenyl)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

(1R)-1-[(1S,2S)-2-(2,4-dichlorophenyl)cyclopropyl]ethanol
CID 28912113
(1S)-1-[(1R,2R)-2-(2,4-dichlorophenyl)cyclopropyl]ethanol
CID 124746698
(1R)-1-[(1S,2S)-2-(2,3-dichlorophenyl)cyclopropyl]ethanamine
CID 29079561
(1S)-1-[(1R,2S)-2-(2,5-difluorophenyl)cyclopropyl]ethanamine
CID 93284927
1-[2-(2,5-difluorophenyl)cyclopropyl]ethanamine
CID 43312619
(1S)-1-[(1S,2S)-2-(2,4-difluorophenyl)cyclopropyl]ethanamine
CID 29079347
1-[2-(3,4-dichlorophenyl)cyclopropyl]ethanamine
CID 43150348
1-[2-(2-chlorothiophen-3-yl)cyclopropyl]ethanamine
CID 130631226
[(1R,2S)-2-(2,4-dichlorophenyl)cyclopropyl]methanamine
CID 94557667
N-[[2-(2,4-dichlorophenyl)cyclopropyl]methyl]propan-2-amine
CID 62708576
4-(2,4-dichlorophenyl)-3-propan-2-ylpiperidine
CID 79321406
(1R)-1-[(1R,2S)-2-(2,6-difluorophenyl)cyclopropyl]ethanamine
CID 29079485

Frequently Asked Questions

What is the IUPAC name of (1R)-1-[(1S,2S)-2-(2,4-dichlorophenyl)cyclopropyl]ethanamine?
The IUPAC name of (1R)-1-[(1S,2S)-2-(2,4-dichlorophenyl)cyclopropyl]ethanamine (CID 28912124) is (1R)-1-[(1S,2S)-2-(2,4-dichlorophenyl)cyclopropyl]ethanamine.
What is the SMILES notation for (1R)-1-[(1S,2S)-2-(2,4-dichlorophenyl)cyclopropyl]ethanamine?
The canonical SMILES for (1R)-1-[(1S,2S)-2-(2,4-dichlorophenyl)cyclopropyl]ethanamine is C[C@@H](N)[C@H]1C[C@@H]1c1ccc(Cl)cc1Cl.
What is the InChIKey of (1R)-1-[(1S,2S)-2-(2,4-dichlorophenyl)cyclopropyl]ethanamine?
The InChIKey is KQJNWEUHGJEKFH-BDODKLCJSA-N. The full InChI is InChI=1S/C11H13Cl2N/c1-6(14)9-5-10(9)8-3-2-7(12)4-11(8)13/h2-4,6,9-10H,5,14H2,1H3/t6-,9-,10-/m1/s1.
What are the key properties of (1R)-1-[(1S,2S)-2-(2,4-dichlorophenyl)cyclopropyl]ethanamine?
(1R)-1-[(1S,2S)-2-(2,4-dichlorophenyl)cyclopropyl]ethanamine has a molecular weight of 230.14 g/mol, XLogP of 3.44, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-[(1S,2S)-2-(2,4-dichlorophenyl)cyclopropyl]ethanamine is sourced from PubChem (CID 28912124), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).