1-[(2,5-dichlorophenyl)methyl]-N-methylcyclopropan-1-amine

C11H13Cl2N — CID 171613045

IUPAC1-[(2,5-dichlorophenyl)methyl]-N-methylcyclopropan-1-amine
SMILESCNC1(Cc2cc(Cl)ccc2Cl)CC1
InChIInChI=1S/C11H13Cl2N/c1-14-11(4-5-11)7-8-6-9(12)2-3-10(8)13/h2-3,6,14H,4-5,7H2,1H3
InChIKeyBCZLXHNKNXQXEG-UHFFFAOYSA-N
MW230.14 g/mol
LogP3.29
Rot. Bonds3

About 1-[(2,5-dichlorophenyl)methyl]-N-methylcyclopropan-1-amine

1-[(2,5-dichlorophenyl)methyl]-N-methylcyclopropan-1-amine (PubChem CID 171613045) has the molecular formula C11H13Cl2N and a molecular weight of 230.14 g/mol. Its IUPAC name is 1-[(2,5-dichlorophenyl)methyl]-N-methylcyclopropan-1-amine.

Molecular Properties

Compound Name1-[(2,5-dichlorophenyl)methyl]-N-methylcyclopropan-1-amine
PubChem CID171613045
Molecular FormulaC11H13Cl2N
Molecular Weight230.14 g/mol
Exact Mass229.04
IUPAC Name1-[(2,5-dichlorophenyl)methyl]-N-methylcyclopropan-1-amine
SMILESCNC1(Cc2cc(Cl)ccc2Cl)CC1
InChIInChI=1S/C11H13Cl2N/c1-14-11(4-5-11)7-8-6-9(12)2-3-10(8)13/h2-3,6,14H,4-5,7H2,1H3
InChIKeyBCZLXHNKNXQXEG-UHFFFAOYSA-N
XLogP3.29
TPSA12.03 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 ≤ 53.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 1-[(2,5-dichlorophenyl)methyl]-N-methylcyclopropan-1-amine 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

1-[(2-chloro-5-fluorophenyl)methyl]-N-methylcyclopropan-1-amine
CID 83689412
1-[(2,5-dichlorophenyl)methyl]cyclobutan-1-amine
CID 65317862
1-[(2,5-dichlorophenyl)methyl]cyclopentan-1-ol
CID 65316755
1-[(2,5-dichlorophenyl)methyl]-3,3-dimethylcyclohexan-1-amine
CID 65317057
1-[(3,4-dichlorophenyl)methyl]-N-methylcyclohexan-1-amine
CID 94697451
1-[(3-chlorophenyl)methyl]-N-methylcyclopentan-1-amine
CID 82128067
2-[(2,5-dichlorophenyl)methyl]-2-propan-2-ylpyrrolidine
CID 66468098
2-[(2,5-dichlorophenyl)methyl]-2-ethylazepane
CID 79116804
1-[(2,5-dichlorophenyl)methyl]-3,4-dimethylcyclohexan-1-ol
CID 65316674
4-tert-butyl-1-[(2,5-dichlorophenyl)methyl]cyclohexan-1-ol
CID 65316707
4-butyl-1-[(2,5-dichlorophenyl)methyl]cyclohexan-1-amine
CID 65318007
1-[(2,5-dichlorophenyl)methyl]-4-ethylcyclohexane-1-carbonitrile
CID 65393899

Frequently Asked Questions

What is the IUPAC name of 1-[(2,5-dichlorophenyl)methyl]-N-methylcyclopropan-1-amine?
The IUPAC name of 1-[(2,5-dichlorophenyl)methyl]-N-methylcyclopropan-1-amine (CID 171613045) is 1-[(2,5-dichlorophenyl)methyl]-N-methylcyclopropan-1-amine.
What is the SMILES notation for 1-[(2,5-dichlorophenyl)methyl]-N-methylcyclopropan-1-amine?
The canonical SMILES for 1-[(2,5-dichlorophenyl)methyl]-N-methylcyclopropan-1-amine is CNC1(Cc2cc(Cl)ccc2Cl)CC1.
What is the InChIKey of 1-[(2,5-dichlorophenyl)methyl]-N-methylcyclopropan-1-amine?
The InChIKey is BCZLXHNKNXQXEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13Cl2N/c1-14-11(4-5-11)7-8-6-9(12)2-3-10(8)13/h2-3,6,14H,4-5,7H2,1H3.
What are the key properties of 1-[(2,5-dichlorophenyl)methyl]-N-methylcyclopropan-1-amine?
1-[(2,5-dichlorophenyl)methyl]-N-methylcyclopropan-1-amine has a molecular weight of 230.14 g/mol, XLogP of 3.29, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(2,5-dichlorophenyl)methyl]-N-methylcyclopropan-1-amine is sourced from PubChem (CID 171613045), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).